Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | SELE | P16581 | 3/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 2/20 | 0.30 |
| ▸ | ICAM1 | P05362 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10144385 | 0.89 | PKM (0.39) | CYP1A2TMIGD3CYP2C9ADORA1MAPK1 | |
| SCHEMBL12651686 | 0.85 | MAPK1 (0.33) | CYP1A2TMIGD3CYP2C9ADORA1MAPK1 | |
| SCHEMBL22845454 | 0.84 | MAPK1 (0.32) | MAPK1HSD17B10 | |
| SCHEMBL9980122 | 0.80 | MAPK1 (0.42) | CYP1A2TMIGD3CYP2C9ADORA1MAPK1 | |
| SCHEMBL18876157 | 0.80 | MAPK1 (0.32) | MAPK1HSD17B10SELEVCAM1ALDH1A1 | |
| SCHEMBL23922164 | 0.78 | — | — | |
| SCHEMBL20091309 | 0.77 | PDPK1 (0.31) | — | |
| SCHEMBL13452605 | 0.74 | GPR35 (0.34) | GPR35 | |
| SCHEMBL22675096 | 0.73 | GPR35 (0.34) | MAPK1HSD17B10GPR35SELEVCAM1 | |
| SCHEMBL19227385 | 0.72 | PPARG (0.35) | CYP1A2TMIGD3CYP2C9ADORA1MAPK1 |
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-20110120558-A1 | SEMICONDUCTOR MATERIALS PREPARED FROM RYLENE-(PI-ACCEPTOR)COPOLYMERS | BASF SE | 2011-05-26 | — | — | US | disclosed |