Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 4/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | PPME1 | Q9Y570 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.31 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.31 |
| ▸ | ACLY | P53396 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.30 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.30 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.30 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.30 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2406675 | 0.93 | HTR2C (0.34) | NR3C2HTR2CSLC6A4HTR2APLCG1 | |
| SCHEMBL4410586 | 0.90 | PPME1 (0.36) | PPME1GRM4POLBCYP2C9CYP2C19 | |
| SCHEMBL2410588 | 0.89 | HTR2C (0.32) | NR3C2HTR2CSLC6A4HTR2APLCG1 | |
| SCHEMBL2414628 | 0.87 | TACR1 (0.35) | HTR2CSLC6A4PIK3C3SQORPLCG1 | |
| SCHEMBL2410003 | 0.87 | HTR2C (0.34) | HTR2CSLC6A4PLCG1KDM2B | |
| SCHEMBL2412641 | 0.86 | HTR2C (0.37) | HTR2CSLC6A4LMNAPLCG1 | |
| SCHEMBL2409374 | 0.86 | HTR2C (0.40) | HTR2CSLC6A4HTR2APOLBKAT6A | |
| SCHEMBL2409829 | 0.86 | HTR2C (0.35) | HTR2CSLC6A4PLCG1KAT6AKAT5 | |
| SCHEMBL2415547 | 0.84 | PPME1 (0.35) | NR3C2PPME1GRM4PIK3C3ACLY | |
| SCHEMBL2416581 | 0.84 | HTR2C (0.32) | HTR2CSLC6A4PLCG1 |
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-2364979-A1 | Pyrrole compounds | Takeda Pharmaceutical Company Limited (JP) | 2011-09-14 | — | — | EP | disclosed |
| EP-2114917-A2 | PYRROLE COMPOUNDS | Takeda Pharmaceutical Company Limited (JP) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008108380-A2 | PYRROLE COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-12 | — | — | WO | disclosed |