Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28752673 | 0.85 | KMT2A (0.37) | KMT2APTPN1PTGS2ALDH1A1LMNA | |
| SCHEMBL27624299 | 0.77 | TSHR (0.43) | PTGER4ALDH1A1SMN1; SMN2 | |
| SCHEMBL27624306 | 0.76 | PTGER4 (0.46) | KMT2APTPN1PTGER4ALDH1A1LMNA | |
| SCHEMBL28290215 | 0.75 | MAOB (0.43) | KMT2APTPN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL2097892 | 0.75 | HNF4A (0.43) | KMT2APTPN1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL28752670 | 0.75 | KMT2A (0.45) | KMT2AALDH1A1LMNASMN1; SMN2CYP1A2 | |
| SCHEMBL8861328 | 0.74 | FABP4 (0.41) | PTPN1ALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL27605106 | 0.70 | KMO (0.44) | KMT2APTPN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL27624418 | 0.70 | PTPN1 (0.36) | PTPN1ALDH1A1LMNAKDM4EHPGD | |
| SCHEMBL3977057 | 0.69 | PTGS1 (0.42) | KMT2AALDH1A1LMNASMN1; SMN2KDM4E |
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-2307394-A2 | NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Amorepacific Corporation (KR) | 2011-04-13 | — | — | EP | disclosed |
| WO-2010002209-A2 | NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | AMOREPACIFIC CORPORATION (KR) | 2010-01-07 | — | — | WO | disclosed |