Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | USP2 | O75604 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL28810058 | 0.84 | MEN1 (0.42) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL18756918 | 0.78 | CHRM2 (0.61) | MEN1KMT2AUSP2CYP2D6CYP3A4 | |
| SCHEMBL18757063 | 0.76 | ALDH1A1 (0.43) | MEN1KMT2ACYP2D6CYP3A4OPRD1 | |
| SCHEMBL693969 | 0.75 | KMT2A (0.66) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL2542420 | 0.74 | MEN1 (0.44) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL14992762 | 0.74 | ALDH1A1 (0.52) | MEN1KMT2ACYP2D6CYP2C9CYP3A4 | |
| SCHEMBL219432 | 0.74 | MEN1 (1.00) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL2794662 | 0.74 | MEN1 (1.00) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL6982497 | 0.73 | CYP3A4 (0.59) | MEN1KMT2AUSP2CYP2D6CYP2C9 | |
| SCHEMBL21441611 | 0.73 | MEN1 (0.46) | MEN1KMT2AUSP2CYP2D6CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0962457-B1 | Piperidones as tachykinin antagonists | PFIZER LTD (GB) | 2003-08-06 | — | — | EP | disclosed |
| EP-0992493-A1 | Substituted benzoylpiperidine derivatives and their use as Neurokinin antagonists | PFIZER INC. (US) | 2000-04-12 | — | — | EP | disclosed |
| EP-0962457-A1 | Piperidones as tachykinin antagonists | Pfizer Limited (GB) | 1999-12-08 | — | — | EP | disclosed |