Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 9/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 7/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 7/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 7/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 3/20 | 0.35 |
| ▸ | RET | P07949 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | FRK | P42685 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL14039836 | 0.81 | MAPK14 (0.43) | MAPK14MAPK13MAPK12MAPK11CSNK1D | |
| SCHEMBL14015670 | 0.75 | HTR2A (0.46) | HTR2AHTR2CHTR7HTR2BMAPK14 | |
| SCHEMBL4304948 | 0.73 | MAPT (0.37) | — | |
| SCHEMBL31617224 | 0.68 | PTGDR2 (0.40) | HTR2AHTR2CHTR7HTR2BMAPK14 | |
| SCHEMBL1555561 | 0.66 | HTR2A (0.35) | HTR2AHTR2CHTR7HTR2BMAPK14 | |
| SCHEMBL1554016 | 0.65 | ESR1 (0.40) | HTR2AHTR2CHTR7HTR2BMAPK14 | |
| SCHEMBL11409851 | 0.65 | ADORA2A (0.40) | HTR2AHTR2CHTR7HTR2BMAPK14 | |
| SCHEMBL9441592 | 0.65 | PTGDR2 (0.46) | MAPK14CSNK1DCSNK1EEGFRCSNK1A1 | |
| SCHEMBL14039938 | 0.65 | MAPK14 (0.43) | MAPK14MAPK13MAPK12MAPK11CSNK1D | |
| SCHEMBL9441575 | 0.64 | SRC (0.40) | MAPK14EGFR |
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 |
|---|---|---|---|---|---|---|---|
| US-7449576-B1 | potent antagonists of the CCR1 receptor; inflammation; (5-Chloro-2-piperazin-1-yl-phenyl)-phenyl-methanone | CHEMOCENTRYX, INC. (US) | 2008-11-11 | — | — | US | disclosed |