Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 20/20 | 0.53 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | NQO2 | P16083 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15129748 | 0.89 | MAP2K1 (0.67) | MAP2K1MAP2K2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15130135 | 0.89 | MAP2K1 (0.67) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL19366620 | 0.89 | MAP2K1 (0.43) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL15130138 | 0.89 | MAP2K1 (0.51) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL19366605 | 0.88 | MAP2K1 (0.54) | MAP2K1MAP2K2ABCB11NQO2 | |
| SCHEMBL15130228 | 0.88 | MAP2K1 (0.51) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL19367210 | 0.87 | MEN1 (0.54) | MAP2K1MAP2K2ABCB11NQO2 | |
| SCHEMBL19367456 | 0.87 | MAP2K1 (0.41) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL19366609 | 0.86 | MAP2K1 (0.49) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 | |
| SCHEMBL15131335 | 0.86 | MAP2K1 (0.51) | MAP2K1MAP2K2ABCB11NQO2CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9937158-B2 | Benzoheterocyclic compounds and use thereof | SHANGHAI KECHOW PHARMA, INC. (CN) | 2018-04-10 | — | — | US | disclosed |
| EP-2804855-B1 | BENZOHETEROCYCLIC COMPOUNDS AND USE THEREOF | SHANGHAI KECHOW PHARMA INC (CN) | 2017-09-20 | — | — | EP | disclosed |