Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR9 | P51686 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.41 |
| ▸ | USP2 | O75604 | 5/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.41 |
| ▸ | CCR2 | P41597 | 4/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2931092 | 0.89 | MAPT (0.47) | CYP1A2CYP3A4CYP2C19USP2CYP2C9 | |
| SCHEMBL2921287 | 0.87 | CYP3A4 (0.40) | CYP1A2CYP3A4CYP2C19USP2CYP2C9 | |
| SCHEMBL2925799 | 0.76 | CYP3A4 (0.38) | CYP1A2CYP3A4CYP2C19USP2CYP2C9 | |
| SCHEMBL2921880 | 0.76 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19USP2CYP2C9 | |
| SCHEMBL2993976 | 0.75 | CCR2 (0.48) | CCR9CCR2ABCB11 | |
| SCHEMBL2924383 | 0.70 | CCR2 (0.76) | CCR2TBXA2RABCB11 | |
| SCHEMBL2929131 | 0.70 | PTGS2 (0.56) | PTGDR2ALDH1A1LMNASMN1; SMN2HPGD | |
| SCHEMBL2926815 | 0.70 | TP53 (0.48) | CYP1A2CYP3A4CYP2C19USP2CYP2C9 | |
| SCHEMBL3119623 | 0.69 | CCR2 (0.55) | CCR9CYP1A2CYP3A4CYP2C19USP2 | |
| SCHEMBL297540 | 0.68 | CCR2 (0.46) | CCR9CCR2ABCB11 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1086950-B1 | HETEROCYCLIC INDOLE DERIVATIVES AND MONO- OR DIAZAINDOLE DERIVATIVES | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2010-09-29 | — | — | EP | disclosed |