Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 5/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.49 |
| ▸ | KIT | P10721 | 5/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10697886 | 0.90 | CYP11B1 (0.47) | CYP11B1CYP11B2KITNAMPTMEN1 | |
| SCHEMBL10699164 | 0.89 | CYP11B1 (0.47) | CYP11B1CYP11B2KITNAMPTMEN1 | |
| SCHEMBL10695521 | 0.87 | CYP11B2 (0.53) | CYP11B1CYP11B2KITNAMPTATM | |
| SCHEMBL10699903 | 0.86 | CYP11B1 (0.47) | CYP11B1CYP11B2KITNAMPTMEN1 | |
| SCHEMBL10698416 | 0.82 | MEN1 (0.37) | MEN1KMT2AMAPT | |
| SCHEMBL10698461 | 0.80 | KDM4E (0.40) | MEN1KMT2AMAPTDHFR | |
| SCHEMBL10697132 | 0.80 | NPC1 (0.48) | MEN1KMT2AMAPTDHFR | |
| SCHEMBL10697875 | 0.78 | CYP11B1 (0.50) | CYP11B1CYP11B2KITNAMPTCYP1A2 | |
| SCHEMBL10700981 | 0.78 | MEN1 (0.37) | MEN1KMT2AMAPT | |
| SCHEMBL10701679 | 0.77 | MEN1 (0.41) | KITNAMPTMEN1KMT2AATM |
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 |