Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | HTR3A | P46098 | 1/20 | 0.54 |
| ▸ | GHSR | Q92847 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7409239 | 0.90 | OPRK1 (0.67) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL7413320 | 0.89 | OPRK1 (0.63) | TP53LMNAOPRK1KCNH2HTR1A | |
| Hydrochloric Acid SCHEMBL7408744 | 0.88 | OPRK1 (0.62) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL11769344 | 0.83 | TP53 (0.72) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL8840932 | 0.82 | TP53 (0.69) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL11577976 | 0.80 | TP53 (0.65) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL7409162 | 0.79 | OPRK1 (0.65) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL11579072 | 0.79 | TP53 (0.64) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL11577333 | 0.79 | TP53 (0.64) | TP53LMNAOPRK1KCNH2HTR1A | |
| SCHEMBL11851286 | 0.79 | OPRK1 (0.74) | TP53LMNAOPRK1KCNH2HTR1A |
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-3989829-A | 1,4-Benzodiazepines | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-11-02 | — | — | US | disclosed |