Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.54 |
| ▸ | DRD2 | P14416 | 3/20 | 0.54 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.51 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.51 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.51 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.47 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | KDM6B | O15054 | 1/20 | 0.43 |
| ▸ | KDM4A | O75164 | 1/20 | 0.43 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.43 |
| ▸ | KDM3B | Q7LBC6 | 1/20 | 0.43 |
| ▸ | HIF1AN | Q9NWT6 | 1/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.43 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8324470 | 0.87 | PTGER1 (0.48) | PTGER1FOLH1ALDH1A1HTT | |
| SCHEMBL8317985 | 0.86 | HTR1A (0.46) | HTR1ADRD2PTGER1PTGER4PTGER3 | |
| SCHEMBL8324638 | 0.84 | MRGPRX4 (0.44) | PTGER1FOLH1 | |
| SCHEMBL8322835 | 0.81 | KDM6B (0.52) | HTR1ADRD2PTGER1PTGER4PTGER3 | |
| SCHEMBL4428193 | 0.80 | DAO (0.54) | KDM6BKDM4AKDM4DKDM3BHIF1AN | |
| SCHEMBL8321988 | 0.80 | HTR1A (0.52) | HTR1ADRD2PTGER1PTGER4PTGER3 | |
| Benzylphenylether SCHEMBL8328497 | 0.78 | NR4A2 (0.46) | ALDH1A1SRD5A2KDM6BKDM4AKDM4D | |
| SCHEMBL8674773 | 0.76 | HTR1A (0.60) | HTR1ADRD2PTGER1PTGER4PTGER3 | |
| SCHEMBL8318934 | 0.75 | HTR1A (0.60) | HTR1ADRD2PTGER1PTGER4PTGER3 | |
| SCHEMBL8675521 | 0.75 | PTGER1 (0.67) | HTR1ADRD2PTGER1PTGER4PTGER3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0733033-B1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LTD (GB) | 1999-12-22 | — | — | EP | disclosed |
| WO-1996011902-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-04-25 | — | — | WO | disclosed |