Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.34 |
| ▸ | IAPP | P10997 | 1/20 | 0.34 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ROR1 | Q01973 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28614793 | 0.81 | CYP3A4 (0.35) | TNFRSF1AS1PR1ALOX5HDAC8MAPT | |
| SCHEMBL28413351 | 0.77 | POLB (0.44) | CYP3A4 | |
| SCHEMBL21957646 | 0.75 | PDE3B (0.43) | MAPTBACE1CYP3A4 | |
| SCHEMBL27986455 | 0.75 | CYP3A4 (0.49) | ALOX5OR51E2CYP3A4CYP2C19 | |
| SCHEMBL28604126 | 0.74 | IAPP (0.40) | ALOX5IAPPOR51E2BACE1CYP1A2 | |
| SCHEMBL28608376 | 0.73 | CYP3A4 (0.38) | ALOX5IAPPOR51E2HDAC8MAPT | |
| SCHEMBL12375248 | 0.73 | CYP3A4 (0.51) | TNFRSF1AMAPTROR1BACE1CYP3A4 | |
| SCHEMBL18957568 | 0.71 | KMT2A (0.39) | TNFRSF1AHDAC8ROR1BACE1CYP3A4 | |
| SCHEMBL18957569 | 0.70 | HDAC3 (0.37) | TNFRSF1AHDAC8MAPTROR1BACE1 | |
| SCHEMBL26047491 | 0.69 | PDE3B (0.42) | MAPTBACE1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109293493-B | Novel benzhydryl compounds with mycobacterium tuberculosis inhibiting activity | 清华大学 | 2021-08-03 | — | — | CN | disclosed |