Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | XIAP | P98170 | 4/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL8118631 | 0.95 | CYP1A2 (0.35) | PTPN1KEAP1NFE2L2HTR1AADRA1A | |
| SCHEMBL8117806 | 0.88 | HTT (0.31) | PTPN1ADAM17HTT | |
| SCHEMBL7532349 | 0.86 | UGCG (0.36) | KEAP1NFE2L2KMT2AADAM17LMNA | |
| SCHEMBL8122599 | 0.86 | — | — | |
| SCHEMBL8122271 | 0.86 | ITGB3 (0.36) | ALDH1A1 | |
| SCHEMBL9029392 | 0.83 | OPRM1 (0.35) | PTPN1ADAM17MMP2MMP9ALDH1A1 | |
| SCHEMBL8118294 | 0.83 | ITGB3 (0.33) | CYP1A2CYP2D6CYP2C9ALDH1A1HTT | |
| SCHEMBL8125482 | 0.83 | ITGB3 (0.33) | CYP1A2CYP2D6CYP2C9ALDH1A1HTT | |
| SCHEMBL7417886 | 0.83 | ITGB3 (0.42) | PTPN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7421979 | 0.82 | LMNA (0.44) | PTPN1KMT2AADAM17DPP4DPP8 |
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-0691953-B1 | 1-AMIDINOPHENYL-PYRROLIDONES/ PIPERIDINONES AS PLATELET AGGREGATION INHIBITORS | SEARLE & CO (US) | 2000-08-02 | — | — | EP | claimed |