Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | HTR1D | P28221 | 9/20 | 0.52 |
| ▸ | HTR1B | P28222 | 9/20 | 0.52 |
| ▸ | HTR1A | P08908 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | NOS3 | P29474 | 2/20 | 0.47 |
| ▸ | NOS1 | P29475 | 2/20 | 0.47 |
| ▸ | GABRP | O00591 | 1/20 | 0.47 |
| ▸ | GABRD | O14764 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8784576 | 0.94 | HTR1D (0.59) | HTR1DHTR1BHTR1ACYP1A2CYP3A4 | |
| SCHEMBL8784390 | 0.82 | HTR1D (0.53) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL8508032 | 0.82 | KDM4E (0.64) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL9269516 | 0.81 | KDM4E (0.62) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL9268538 | 0.77 | HTR1D (0.71) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL8784342 | 0.76 | HTR1A (0.53) | KDM4EATMHTR1DHTR1BHTR1A | |
| Hydrochloric Acid SCHEMBL9269587 | 0.76 | HTR1D (0.57) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL8508491 | 0.75 | KDM4E (0.68) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL8784644 | 0.75 | HTR1D (0.53) | KDM4EATMHTR1DHTR1BHTR1A | |
| SCHEMBL9272206 | 0.75 | HTR1D (0.88) | KDM4EATMHTR1DHTR1BHTR1A |
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-0497512-B1 | Imidazole, triazole and tetrazole derivatives | MERCK SHARP & DOHME (GB) | 1997-09-24 | — | — | EP | claimed |