Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL2642364 | 0.71 | MEN1 (0.39) | OPRM1OPRK1OPRL1MEN1KMT2A | |
| SCHEMBL28061487 | 0.69 | HSD11B1 (0.38) | CYP1A2OPRM1OPRK1OPRL1TSHR | |
| SCHEMBL23748537 | 0.67 | OPRM1 (0.32) | OPRM1OPRK1OPRL1MEN1KMT2A | |
| SCHEMBL30312220 | 0.67 | OPRM1 (0.50) | OPRM1OPRK1OPRL1MEN1KMT2A | |
| SCHEMBL8018743 | 0.66 | OPRL1 (0.33) | OPRM1OPRK1OPRL1MEN1KMT2A | |
| SCHEMBL5684310 | 0.64 | HSD11B1 (0.40) | CYP1A2OPRM1OPRK1OPRL1HSD11B1 | |
| SCHEMBL9608820 | 0.64 | HSD11B1 (0.40) | CYP1A2OPRM1OPRK1OPRL1TSHR | |
| SCHEMBL22123806 | 0.64 | DPP4 (0.35) | OPRM1OPRK1OPRL1PNMT | |
| SCHEMBL11465523 | 0.63 | HSD11B1 (0.39) | CYP1A2OPRM1OPRK1OPRL1TSHR | |
| SCHEMBL343450 | 0.63 | ALDH1A1 (0.45) | CYP1A2OPRM1OPRK1OPRL1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101219984-A | Amine salt compound of carboxylic acid having thermal dissociation portion and compounding agent for rubber vulcanization and rubber composition containing the same | YOKOHAMA RUBBER CO LTD (JP) | 2008-07-16 | — | — | CN | disclosed |