Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27997437 | 0.84 | TDP1 (0.46) | TDP1CYP2A6PKMCYP4F2CYP4A11 | |
| SCHEMBL20562979 | 0.83 | CBFB (0.43) | CYP2A6KMT2AGRIN1GRIN2BCYP1A2 | |
| SCHEMBL2313052 | 0.80 | TDP1 (0.42) | TDP1CYP2A6PKMCYP4F2CYP4A11 | |
| SCHEMBL20563261 | 0.79 | TAAR1 (0.57) | TAAR1 | |
| SCHEMBL13395654 | 0.76 | KMT2A (0.53) | TDP1CYP2A6KMT2AGRIN1GRIN2B | |
| SCHEMBL29700257 | 0.76 | KMT2A (0.53) | TDP1CYP2A6KMT2AGRIN1GRIN2B | |
| SCHEMBL8035450 | 0.75 | TDP1 (0.38) | TDP1CYP2A6CYP4F2CYP4A11TAAR1 | |
| SCHEMBL15310451 | 0.75 | IDO1 (0.42) | TDP1CYP4F2CYP4A11CYP1A2 | |
| SCHEMBL15345788 | 0.74 | PNMT (0.54) | CYP2A6KMT2AGRIN1GRIN2BTAAR1 | |
| SCHEMBL2316615 | 0.74 | TDP1 (0.41) | TDP1CYP4F2CYP4A11CYP1A2 |
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-6022822-A | Organotin compound and catalyst for transesterification comprising the same | RYOJI NOYORI (JP) | 2000-02-08 | — | — | US | disclosed |