Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | CRBN | Q96SW2 | 7/20 | 0.54 |
| ▸ | IKZF3 | Q9UKT9 | 4/20 | 0.50 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | HTR2B | P41595 | 3/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | TNF | P01375 | 2/20 | 0.43 |
| ▸ | IL1B | P01584 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10974936 | 1.00 | ALDH1A1 (0.55) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL10974938 | 1.00 | ALDH1A1 (0.55) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL7270310 | 0.91 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL5121758 | 0.91 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL7709727 | 0.91 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL5710904 | 0.89 | ALDH1A1 (0.62) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL13595399 | 0.82 | HTR2C (0.65) | ALDH1A1CYP1A2HTR2CHTR2BHTR2A | |
| SCHEMBL13980479 | 0.81 | ALDH1A1 (0.43) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL4408466 | 0.81 | HTR2A (0.50) | ALDH1A1GAAKDM4EMAPTCRBN | |
| SCHEMBL13980553 | 0.81 | LRRK2 (0.44) | ALDH1A1GAAKDM4EMAPTCRBN |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0059387-B1 | IMIDAZODIAZEPINES, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PREPARATION, AND MEDICINES CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1985-05-08 | — | — | EP | disclosed |
| US-4407752-A | ANTIDEPRESSANT, MUSCLE RELAXANTS, SEDATIVES, HYPOTENSIVE AGENTS, TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1983-10-04 | — | — | US | disclosed |
| US-4405517-A | ANTAGONIST FOR 1,4-BENZODIAZEPINES USED AS TRANQUILIZERS, MUSCLE RELAXANTS, HYPOTENSIVE AGENTS AND CENTRAL NERVOUS SYSTEM DEPRESSANTS | HOFFMANN-LA ROCHE INC. (US) | 1983-09-20 | — | — | US | disclosed |
| US-4382032-A | CENTRAL NERVOUS SYSTEM DEPRESSANT, HYPOTENSIVE AGENT, TRANQUILIZER | HOFFMANN-LA ROCHE INC. (US) | 1983-05-03 | — | — | US | disclosed |
| US-4352816-A | ANTIDOTES FOR INTOXICATION CAUSED BY 1,4-BENZODIAZEPINE TRANQUILIZERS | HOFFMANN-LA ROCHE INC. (US) | 1982-10-05 | — | — | US | disclosed |
| EP-0059387-A2 | Imidazodiazepines, process and intermediate products for their preparation, and medicines containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-09-08 | — | — | EP | disclosed |