Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 3/20 | 0.34 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5229287 | 0.88 | EGFR (0.40) | ALDH1A1ALPLKDM4EHTTGAA | |
| SCHEMBL5228002 | 0.87 | TSHR (0.39) | HTR2CMCHR1ALDH1A1KDM4EHTT | |
| SCHEMBL5226446 | 0.86 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAA | |
| SCHEMBL5227634 | 0.85 | PDCD1 (0.40) | ALDH1A1KDM4E | |
| SCHEMBL1998836 | 0.84 | HTR2C (0.39) | HTR2CMCHR1CXCR3F10ADORA2A | |
| SCHEMBL2003024 | 0.84 | HTR2C (0.37) | HTR2CMCHR1ALDH1A1ROCK2GAA | |
| SCHEMBL5228505 | 0.84 | F10 (0.48) | F10 | |
| SCHEMBL5224673 | 0.84 | SMO (0.40) | DRD2DRD4ALDH1A1ALPLKDM4E | |
| SCHEMBL5224744 | 0.84 | HTR1A (0.38) | HTR2CALDH1A1ALPLKDM4EROCK2 | |
| SCHEMBL5226613 | 0.84 | SMO (0.40) | DRD2DRD4ALDH1A1ALPLKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |