Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | KCNK3 | O14649 | 10/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9659999 | 0.89 | KCNK3 (0.46) | MAPK1KCNK3KCNH2GPBAR1BRD4 | |
| Hydrochloric Acid SCHEMBL9658199 | 0.80 | MAPK1 (0.57) | MAPK1KCNK3GABRG2GABRB3GABRA5 | |
| Water SCHEMBL9660273 | 0.80 | MAPK1 (0.57) | MAPK1KCNK3GABRG2GABRB3GABRA5 | |
| SCHEMBL183240 | 0.79 | HTR2A (0.57) | MAPK1KCNK3GABRG2GABRB3GABRA5 | |
| Hydrochloric Acid SCHEMBL9658377 | 0.72 | HTR2A (0.61) | — | |
| Water SCHEMBL9658363 | 0.71 | CREBBP (0.47) | MAPK1KCNK3GABRG2GABRB3GABRA5 | |
| SCHEMBL9659657 | 0.71 | CLPP (0.39) | MAPK1GPBAR1 | |
| Hydrochloric Acid SCHEMBL9659841 | 0.71 | BRD4 (0.53) | KCNK3BRD4CREBBP | |
| SCHEMBL9659996 | 0.71 | CREBBP (0.46) | MAPK1KCNK3GABRG2GABRB3GABRA5 | |
| SCHEMBL9658344 | 0.71 | HTR2A (0.53) | MAPK1KCNK3GABRG2GABRB3GABRA5 |
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-5137890-A | Gastrointestinal disorders, antiulcer agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-08-11 | — | — | US | claimed |
| US-5137890-A | Gastrointestinal disorders, antiulcer agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1992-08-11 | — | — | US | disclosed |