Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | FABP7 | O15540 | 1/20 | 0.40 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18281695 | 0.91 | KMT2A (0.43) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL696626 | 0.90 | CYP3A4 (0.40) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL6285067 | 0.84 | CPB1 (0.44) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL15665799 | 0.83 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL15665561 | 0.83 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL3295119 | 0.81 | CYP2C19 (0.45) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL14842868 | 0.80 | CYP3A4 (0.47) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL8723700 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2NPC1RAB9ACYP2C19CYP3A4 | |
| SCHEMBL6634962 | 0.74 | LMNA (0.46) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL489617 | 0.74 | SMN1; SMN2 (0.42) | SMN1; SMN2NPC1RAB9ACYP3A4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2496572-A1 | BENZIMIDAZOLE-IMIDAZOLE DERIVATIVES | Janssen R&D Ireland (IE) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011054834-A1 | BENZIMIDAZOLE-IMIDAZOLE DERIVATIVES | TIBOTEC PHARMACEUTICALS (IE) | 2011-05-12 | — | — | WO | disclosed |
| EP-1866291-A1 | ANTIBACTERIAL AMIDE MACROCYCLES VI | AiCuris GmbH & Co. KG (DE) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006103009-A1 | ANTIBACTERIAL AMIDE MACROCYCLES VI | AICURIS GMBH & CO. KG (DE) | 2006-10-05 | — | — | WO | disclosed |