Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 10/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTR4 | Q13639 | 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 | |
|---|---|---|---|---|
| SCHEMBL739544 | 0.94 | HRH1 (0.40) | HRH1KCNH2CYP2D6CHRM1MCHR1 | |
| SCHEMBL742482 | 0.93 | HRH1 (0.39) | HRH1KCNH2CYP2D6CHRM1 | |
| SCHEMBL740410 | 0.92 | HRH1 (0.40) | HRH1KCNH2CYP2D6CHRM1KDM4E | |
| SCHEMBL740411 | 0.92 | HRH1 (0.40) | HRH1KCNH2CYP2D6CHRM1KDM4E | |
| SCHEMBL739476 | 0.88 | HRH1 (0.43) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL762905 | 0.88 | ATM (0.41) | HRH1KCNH2CYP2D6ATMCHRM1 | |
| SCHEMBL742693 | 0.88 | HRH1 (0.41) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL742873 | 0.88 | HRH1 (0.41) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL742872 | 0.88 | HRH1 (0.41) | HRH1KCNH2CYP2D6CHRM1USP2 | |
| SCHEMBL741096 | 0.88 | ATM (0.40) | HRH1KCNH2CYP2D6ATMCHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |