Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.40 |
| ▸ | DPP4 | P27487 | 5/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 4/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22077636 | 1.00 | CYP3A4 (0.45) | CYP3A4CYP1A2CYP2D6TSHRMAPK1 | |
| SCHEMBL3807599 | 0.77 | RIPK1 (0.43) | CYP2D6RIPK1DPP4KDM4EDPP8 | |
| SCHEMBL22436253 | 0.77 | TDP1 (0.33) | RIPK1OPRM1 | |
| SCHEMBL25411430 | 0.76 | CYP2D6 (0.32) | CYP2D6RIPK1DPP4LMNA | |
| SCHEMBL859746 | 0.73 | RIPK1 (0.35) | CYP3A4RIPK1KDM4EMEN1KMT2A | |
| SCHEMBL23826433 | 0.71 | DPP4 (0.34) | DPP4DPP7DPP8 | |
| SCHEMBL23825766 | 0.71 | DPP4 (0.34) | DPP4DPP7DPP8 | |
| SCHEMBL23826651 | 0.70 | DPP4 (0.33) | DPP4DPP7DPP8 | |
| SCHEMBL3533635 | 0.70 | DPP4 (0.51) | CYP3A4CYP1A2CYP2D6TSHRMAPK1 | |
| SCHEMBL3533638 | 0.70 | DPP4 (0.51) | CYP3A4CYP1A2CYP2D6TSHRMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3640242-A1 | ROCK-INHIBITING COMPOUND AND USES THEREOF | Hitgen Ltd. (CN) | 2020-04-22 | — | — | EP | disclosed |