Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8301187 | 0.89 | KDM4E (0.34) | KMT2ATSHRCA2CHKA | |
| SCHEMBL8296784 | 0.84 | CA2 (0.36) | KMT2ATSHRCA2CHKACYP1A2 | |
| SCHEMBL6160228 | 0.83 | CYP1A2 (0.33) | KMT2ACYP1A2 | |
| SCHEMBL6158571 | 0.82 | PPIA (0.35) | CYP1A2CYP3A4 | |
| SCHEMBL6159570 | 0.82 | MAPT (0.32) | CYP1A2 | |
| SCHEMBL6159606 | 0.82 | OPRM1 (0.42) | KMT2A | |
| SCHEMBL8913129 | 0.81 | INMT (0.33) | KMT2ATSHRBLM | |
| SCHEMBL8300486 | 0.81 | TSHR (0.34) | TSHR | |
| SCHEMBL8301176 | 0.80 | HTT (0.36) | KMT2ACA2CYP1A2 | |
| SCHEMBL27661365 | 0.80 | TSHR (0.38) | KMT2ATSHRCA2CYP1A2CYP3A4 |
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-0808303-A1 | 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST | ZENECA LIMITED (GB) | 1997-11-26 | — | — | EP | disclosed |
| WO-1996024582-A1 | 5-(4-SUBST.-PIPERIDINYL-1)-3-ARYL-PENTANOIC ACID DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONIST | ZENECA LIMITED (GB) | 1996-08-15 | — | — | WO | disclosed |