Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | BRD4 | O60885 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10698013 | 0.95 | CA12 (0.50) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL10700187 | 0.85 | CA12 (0.45) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL10699035 | 0.81 | CA12 (0.45) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL10695172 | 0.80 | MEN1 (0.47) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL10698809 | 0.79 | CYP11B1 (0.53) | KMT2AMEN1BACE1HTT | |
| SCHEMBL10697084 | 0.77 | MEN1 (0.40) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL10695132 | 0.76 | CBFB (0.54) | NPC1RAB9AKMT2AL3MBTL1KDM4E | |
| SCHEMBL10697210 | 0.76 | CA12 (0.51) | CA12CA9NPC1RAB9AKMT2A | |
| SCHEMBL10695690 | 0.75 | MEN1 (0.47) | CA12CA9NPC1RAB9ABRD4 | |
| SCHEMBL16323841 | 0.74 | BACE1 (0.47) | BRD4BACE1PDE4APDE4BPDE4C |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268178-A1 | Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-05-25 | — | — | EP | disclosed |