Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | ATIC | P31939 | 1/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | MPL | P40238 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | NSD2 | O96028 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | IDE | P14735 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14431272 | 0.84 | CYP1A2 (0.52) | CDK2CYP1A2ATICAURKAAURKB | |
| SCHEMBL8928536 | 0.78 | CDK2 (0.48) | CDK2CYP1A2ATICAURKAAURKB | |
| SCHEMBL27566003 | 0.78 | CDK2 (0.53) | CDK2CYP1A2ATICAURKAAURKB | |
| SCHEMBL27582411 | 0.77 | CTRB1 (0.47) | CYP1A2MPLMEN1KMT2AHSD17B10 | |
| SCHEMBL7753514 | 0.75 | AURKA (0.54) | CDK2CYP1A2AURKAAURKBLDHA | |
| SCHEMBL10424569 | 0.70 | CTSB (0.56) | CDK2MEN1KMT2ANSD2POLB | |
| SCHEMBL6708327 | 0.69 | IDO1 (0.59) | CYP1A2GLO1LDHAHSD17B10HPGD | |
| SCHEMBL14443970 | 0.69 | CYP1A2 (0.38) | CYP1A2MPLMEN1KMT2ABLM | |
| Biphenyl SCHEMBL27653456 | 0.69 | CDK2 (0.40) | CDK2CYP1A2AURKAAURKBLDHA | |
| SCHEMBL582872 | 0.68 | ALDH1A1 (0.43) | CDK2CYP1A2AURKAAURKBMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160160065-A1 | INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2016-06-09 | — | — | US | disclosed |