Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD38 | P28907 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | QPCT | Q16769 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.42 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14742539 | 0.82 | KDM4E (0.44) | KDM4ENPC1RAB9AGFERATM | |
| SCHEMBL888653 | 0.80 | — | — | |
| SCHEMBL28029054 | 0.78 | — | — | |
| SCHEMBL8376540 | 0.71 | DRD2 (0.42) | NPC1RAB9AGFERALDH1A1LMNA | |
| 1-Methylimidazole SCHEMBL28947361 | 0.67 | NFKB1 (0.75) | NFKB1QPCTHSD17B10QPCTLTBXAS1 | |
| 1-Methylimidazole SCHEMBL19356956 | 0.67 | NFKB1 (0.75) | NFKB1QPCTHSD17B10QPCTLTBXAS1 | |
| 1-Methylimidazole SCHEMBL8719680 | 0.67 | — | — | |
| 1-Methylimidazole SCHEMBL27892740 | 0.67 | NFKB1 (0.94) | NFKB1QPCTHSD17B10QPCTLTBXAS1 | |
| Phthalic Acid SCHEMBL12076342 | 0.66 | NFKB1 (0.54) | NFKB1QPCTHSD17B10QPCTLTBXAS1 | |
| Benzoic Acid SCHEMBL2804715 | 0.66 | NFKB1 (0.54) | NFKB1QPCTHSD17B10QPCTLTBXAS1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170313747-A1 | SELF-ASSEMBLED NANOSTRUCTURES | DOE-DEITR | 2017-11-02 | — | — | US | disclosed |
| US-9650421-B2 | Self-assembled nanostructures | NORTHWESTERN UNIVERSITY (US) | 2017-05-16 | — | — | US | disclosed |
| US-20150031127-A1 | SELF-ASSEMBLED NANOSTRUCTURES | NORTHWESTERN UNIVERSITY (US) | 2015-01-29 | — | — | US | disclosed |
| EP-1599474-B1 | Heterocyclic oligomeric compounds for DNA recognition | CALIFORNIA INST OF TECHN (US) | 2013-04-24 | — | — | EP | disclosed |
| WO-2013033658-A1 | SELF-ASSEMBLED NANOSTRUCTURES | NORTHWESTERN UNIVERSITY (US) | 2013-03-07 | — | — | WO | disclosed |
| US-7087378-B1 | Design, synthesis and use of specific polyamide DNA-binding ligands | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2006-08-08 | — | — | US | disclosed |
| US-6472537-B1 | POLYMERS FROM PRIMARY AMINE AND CARBOXYLIC ACID SUBSTITUTED PYROLE, HYDROXYPYROLE AND IMIDAZOLE MONOMERS AND HAVING 4-AMINOBUTYRIC ACID LINKER FORMING HAIRPIN TURNS AND OPTION-ALLY AMINO ACID RESIDUES; BINDING TO SPECIFIC | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2002-10-29 | — | — | US | disclosed |
| EP-0973740-A1 | DESIGN, SYNTHESIS AND USE OF SPECIFIC POLYAMIDE DNA-BINDING LIGANDS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2000-01-26 | — | — | EP | disclosed |
| EP-0968186-A1 | IMPROVED POLYAMIDES FOR BINDING IN THE MINOR GROOVE OF DOUBLE STRANDED DNA | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037066-A9 | IMPROVED POLYAMIDES FOR BINDING IN THE MINOR GROOVE OF DOUBLE STRANDED DNA | — | 1999-02-04 | — | — | WO | disclosed |
| WO-1998037067-A1 | DESIGN, SYNTHESIS AND USE OF SPECIFIC POLYAMIDE DNA-BINDING LIGANDS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1998-08-27 | — | — | WO | disclosed |
| WO-1998037066-A1 | IMPROVED POLYAMIDES FOR BINDING IN THE MINOR GROOVE OF DOUBLE STRANDED DNA | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1998-08-27 | — | — | WO | disclosed |