Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | FAAH | O00519 | 7/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | BCR | P11274 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15534142 | 0.85 | ABL1 (0.46) | TRPV1CYP1A2CYP3A4FAAHCYP2D6 | |
| SCHEMBL15533597 | 0.84 | TRPV1 (0.46) | TRPV1CYP1A2CYP3A4FAAHMAPT | |
| SCHEMBL15534052 | 0.80 | EGFR (0.55) | TRPV1CYP1A2CYP3A4FAAHEGFR | |
| SCHEMBL15534101 | 0.78 | TRPV1 (0.47) | TRPV1FAAHTP53MAPTMAPK1 | |
| SCHEMBL15534046 | 0.78 | ABL1 (0.68) | TRPV1CYP1A2CYP3A4FAAHTP53 | |
| Bromide SCHEMBL15534396 | 0.77 | TRPV1 (0.47) | TRPV1FAAHTP53MAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL15533549 | 0.77 | TRPV1 (0.47) | TRPV1FAAHTP53MAPTMAPK1 | |
| SCHEMBL15533101 | 0.77 | CCNB2 (0.55) | MAPTAURKA | |
| SCHEMBL15533814 | 0.77 | ABL1 (0.59) | TRPV1FAAHEGFRTP53MAPT | |
| SCHEMBL15534377 | 0.77 | KMT2A (0.59) | TRPV1CYP1A2CYP3A4TP53MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | claimed |
| WO-2013175415-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AND USES THEREOF | Piramal Enterprises Limited (IN) | 2013-11-28 | — | — | WO | disclosed |