Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | B3GNT2 | Q9NY97 | 3/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL27776790 | 0.90 | POLB (0.41) | POLBB3GNT2DAOP2RX7OPRM1 | |
| SCHEMBL27755968 | 0.86 | B3GNT2 (0.44) | B3GNT2DAOMDM2ADORA3 | |
| SCHEMBL14664128 | 0.83 | POLB (0.54) | POLBB3GNT2DAOP2RX7OPRM1 | |
| SCHEMBL2308145 | 0.83 | POLB (0.57) | POLBB3GNT2DAOMEN1CYP1A2 | |
| SCHEMBL19410170 | 0.83 | POLB (0.57) | POLBB3GNT2DAOMEN1CYP1A2 | |
| SCHEMBL2308151 | 0.83 | POLB (0.57) | POLBB3GNT2DAOMEN1CYP1A2 | |
| SCHEMBL14828728 | 0.81 | POLB (0.58) | POLBB3GNT2DAOP2RX7OPRM1 | |
| Tert-Butyl Formate SCHEMBL27776805 | 0.81 | B3GNT2 (0.40) | B3GNT2DAOMDM2ADORA3 | |
| Tert-Butyl Formate SCHEMBL27755963 | 0.81 | B3GNT2 (0.39) | POLBB3GNT2MDM2 | |
| SCHEMBL639518 | 0.81 | POLB (0.57) | POLBDAOP2RX7OPRM1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101528712-B | Substituted benzimidazolone derivatives, medicaments containing them and the use thereof | ABBOTT GMBH & CO KG | 2013-10-30 | — | — | CN | disclosed |
| CN-101528712-A | Substituted benzimidazolone derivatives, medicaments containing them and the use thereof | ABBOTT GMBH & CO KG (DE) | 2009-09-09 | — | — | CN | disclosed |