Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4827396 | 0.80 | GAA (0.43) | NPC1RAB9AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL10545379 | 0.71 | MEN1 (0.40) | NPC1RAB9AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL10884861 | 0.69 | ALDH1A1 (0.35) | KDM4EALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL10389178 | 0.68 | ALDH1A1 (0.35) | NPC1RAB9AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL8014019 | 0.68 | KDM4E (0.38) | KDM4EALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL8019417 | 0.68 | KDM4E (0.38) | KDM4EALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL8883410 | 0.67 | KDM4E (0.38) | RAB9AKDM4EALDH1A1POLBDHODH | |
| SCHEMBL4259463 | 0.67 | LMNA (0.33) | P2RX7LMNAHCRTR1HCRTR2KMT2A | |
| SCHEMBL16327606 | 0.66 | L3MBTL1 (0.47) | NPC1RAB9AL3MBTL1KDM4EALDH1A1 | |
| SCHEMBL10890403 | 0.66 | BRD4 (0.36) | RAB9AKDM4EALDH1A1HPGDHSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020064790-A1 | Design of drugs involving receptor-ligand-DNA interactions | HENDRY LAWRENCE B (US) | 2002-05-30 | — | — | US | disclosed |
| EP-0740708-A4 | DESIGN OF DRUGS INVOLVING RECEPTOR-LIGAND-DNA INTERACTIONS | HENDRY LAWRENCE B (US) | 1999-12-01 | — | — | EP | disclosed |
| EP-0740708-A1 | DESIGN OF DRUGS INVOLVING RECEPTOR-LIGAND-DNA INTERACTIONS | Hendry, Lawrence B. (US) | 1996-11-06 | — | — | EP | disclosed |
| WO-1995014791-A1 | DESIGN OF DRUGS INVOLVING RECEPTOR-LIGAND-DNA INTERACTIONS | HENDRY LAWRENCE B (US) | 1995-06-01 | — | — | WO | disclosed |