Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | BRAF | P15056 | 3/20 | 0.50 |
| ▸ | RAF1 | P04049 | 3/20 | 0.50 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9712601 | 0.93 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9712607 | 0.84 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9713410 | 0.84 | CYP1A2 (0.55) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9712754 | 0.82 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| Isoxaben SCHEMBL8539623 | 0.82 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9712960 | 0.82 | MAPK14 (0.54) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| Isoxaben SCHEMBL54432 | 0.82 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL25763536 | 0.81 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9712944 | 0.81 | ALDH1A1 (0.53) | CYP1A2CYP3A4CYP2C19BRAFRAF1 | |
| SCHEMBL9713654 | 0.81 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19BRAFRAF1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5086184-A | Herbicides | DOWELANCO (US) | 1992-02-04 | — | — | US | disclosed |
| US-4943634-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1990-07-24 | — | — | US | disclosed |
| US-4801718-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1989-01-31 | — | — | US | disclosed |
| US-4636243-A | HERBICIDES ISOXAZOLES | ELI LILLY AND COMPANY (US) | 1987-01-13 | — | — | US | disclosed |
| US-4515625-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1985-05-07 | — | — | US | disclosed |
| EP-0049071-B1 | N-ARYLBENZAMIDE DERIVATIVES | ELI LILLY AND COMPANY (US) | 1984-12-19 | — | — | EP | disclosed |
| US-4416683-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1983-11-22 | — | — | US | disclosed |
| EP-0049071-A1 | N-arylbenzamide derivatives | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |