Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 8/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10566219 | 0.84 | PARP1 (0.45) | PARP1CHEK2RPS6KB1CHRM4CHRM5 | |
| SCHEMBL10370276 | 0.79 | CHRM4 (0.44) | PARP1CHEK2RPS6KB1CHRM4CHRM5 | |
| SCHEMBL10566359 | 0.77 | RPS6KB1 (0.44) | PARP1CHEK2RPS6KB1CHRM4CHRM5 | |
| SCHEMBL10568631 | 0.73 | KDM4E (0.40) | PARP1CHEK2RPS6KB1CHRM4CHRM5 | |
| SCHEMBL10370921 | 0.70 | KCNH2 (0.52) | CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL10369009 | 0.69 | IRAK4 (0.55) | CHEK2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL10370107 | 0.69 | HTR2C (0.56) | CHEK2 | |
| SCHEMBL10371957 | 0.68 | CHEK2 (0.39) | PARP1CHEK2RPS6KB1CHRM4CHRM5 | |
| SCHEMBL10564980 | 0.68 | IRAK4 (0.46) | PARP1CHEK2RPS6KB1PARP2 | |
| SCHEMBL6823927 | 0.67 | CNR2 (0.48) | CHRM4CHRM3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4812565-A | ANTIHISTAMINE INTERMEDIATES | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-03-14 | — | — | US | disclosed |
| US-4810795-A | ANTIHISTAMINES | A. H. ROBINS COMPANY, INCORPORATED (US) | 1989-03-07 | — | — | US | disclosed |
| US-4727152-A | Intermediates useful in the preparation of fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof | A. H. ROBINS COMPANY, INC. (US) | 1988-02-23 | — | — | US | disclosed |
| US-4705853-A | ANTIHISTAMINES | A. H. ROBINS COMPANY, INC. (US) | 1987-11-10 | — | — | US | disclosed |
| US-4642343-A | ANTIHISTAMINES | A. H. ROBINS COMPANY, INCORPORATED (US) | 1987-02-10 | — | — | US | disclosed |
| US-4604388-A | Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof in a method of counteracting histamine | A. H. ROBINS COMPANY, INCORPORATED (US) | 1986-08-05 | — | — | US | disclosed |
| US-4592866-A | Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof | A. H. ROBINS COMPANY, INC. (US) | 1986-06-03 | — | — | US | disclosed |