Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | SCN4A | P35499 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2409010 | 0.86 | CYP1A2 (0.53) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL2666286 | 0.83 | KMO (0.47) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL8365594 | 0.80 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL6439475 | 0.79 | CNR2 (0.50) | GRM5CYP2D6MAPK1CNR2MAOA | |
| SCHEMBL2666281 | 0.78 | L3MBTL1 (0.40) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL9369946 | 0.78 | GRM5 (0.46) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL24181632 | 0.77 | GRM5 (0.33) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL1429685 | 0.76 | CYP1A2 (0.43) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL10678910 | 0.74 | DPP4 (0.44) | GRM5CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL8365591 | 0.74 | CYP1A2 (0.64) | CYP1A2CYP3A4CYP2C19CYP2D6MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8580857-B2 | Methods and compositions to determine the chemosensitizing dose of suramin used in combination therapy | AU JESSIE L-S (US) | 2013-11-12 | — | — | US | claimed |
| US-7625860-B2 | Methods and compositions for modulating cell proliferation and cell death | AU JESSIE L-S | 2009-12-01 | — | — | US | disclosed |
| US-20040010001-A1 | Methods and compositions for modulating cell proliferation and cell death | AU JESSIE L-S (US) | 2004-01-15 | — | — | US | disclosed |
| WO-2002076983-A1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 2002-10-03 | — | — | WO | disclosed |