Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 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 | |
|---|---|---|---|---|
| SCHEMBL9806370 | 0.82 | CYP2C19 (0.56) | CYP3A4CYP2C19TSHRCYP1A2TDP1 | |
| SCHEMBL19130800 | 0.82 | CYP2C19 (0.56) | CYP3A4CYP2C19TSHRCYP1A2TDP1 | |
| SCHEMBL17111064 | 0.79 | CYP2C19 (0.44) | CYP3A4CYP2C19TSHRCYP1A2TDP1 | |
| SCHEMBL11629409 | 0.78 | CYP3A4 (0.62) | CYP3A4CYP2C19CYP3A5KCNA5CYP19A1 | |
| SCHEMBL1375896 | 0.78 | CYP19A1 (0.55) | CYP3A4CYP2C19CYP3A5KCNA5CYP19A1 | |
| SCHEMBL29226694 | 0.77 | KCNA5 (0.56) | CYP3A4CYP2C19KCNA5CYP19A1CYP11B1 | |
| SCHEMBL30927960 | 0.77 | KCNA5 (0.56) | CYP3A4CYP2C19KCNA5CYP19A1CYP11B1 | |
| SCHEMBL19013951 | 0.77 | KCNA5 (0.56) | CYP3A4CYP2C19KCNA5CYP19A1CYP11B1 | |
| SCHEMBL19130465 | 0.74 | TSHR (0.44) | CYP3A4CYP2C19TSHRCYP1A2CYP2C9 | |
| SCHEMBL7120000 | 0.73 | CYP2C19 (0.47) | CYP3A4CYP2C19TSHRCYP1A2LMNA |
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-4734406-A | 3-pyridylmethylnaphthyl derivatives and composition containing them useful to inhibit thromboxane synthetase | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-03-29 | — | — | US | disclosed |