Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | ACLY | P53396 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29213635 | 0.74 | MEN1 (0.42) | MEN1KMT2AALDH1A1TDP1ACLY | |
| SCHEMBL4600326 | 0.73 | AR (0.35) | MEN1KMT2ARAB9AMETAP2FFAR4 | |
| SCHEMBL10973832 | 0.72 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1THRBACLY | |
| SCHEMBL4276345 | 0.70 | ALDH1A1 (0.42) | MEN1KMT2AALDH1A1THRBACLY | |
| SCHEMBL6535943 | 0.69 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1THRBRAB9A | |
| SCHEMBL30583087 | 0.69 | CYP2A6 (0.50) | THRATHRBMETAP2FFAR4CYP2A6 | |
| SCHEMBL27907871 | 0.69 | CYP2A6 (0.50) | THRATHRBMETAP2FFAR4CYP2A6 | |
| SCHEMBL4032566 | 0.69 | LMNA (0.38) | MEN1KMT2AALDH1A1TDP1THRB | |
| SCHEMBL6535972 | 0.69 | FFAR4 (0.43) | MEN1KMT2AALDH1A1RAB9AFFAR4 | |
| SCHEMBL2041747 | 0.69 | MEN1 (0.35) | MEN1KMT2AALDH1A1TDP1RAB9A |
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-1910292-A1 | PIPERIDINE DERIVATIVE AS TACHYKININ RECEPTOR ANTAGONIST | Takeda Pharmaceutical Company Limited (JP) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007015588-A1 | PIPERIDINE DERIVATIVE AS TACHYKININ RECEPTOR ANTAGONIST | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-02-08 | — | — | WO | disclosed |