Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IAPP | P10997 | 3/20 | 0.46 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.39 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | FASN | P49327 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 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 | |
|---|---|---|---|---|
| SCHEMBL28604126 | 0.83 | IAPP (0.40) | IAPPIMPDH2ALOX5OR51E2CYP3A4 | |
| SCHEMBL28919445 | 0.80 | IMPDH2 (0.45) | IMPDH2ALOX5CYP3A4CYP1A2 | |
| SCHEMBL28618562 | 0.79 | NPC1 (0.52) | ALOX5CYP3A4HTR1A | |
| SCHEMBL28603861 | 0.76 | HMGCR (0.44) | IMPDH2ALOX5ALDH1A1FASN | |
| SCHEMBL28612635 | 0.76 | IAPP (0.49) | IAPPALOX5OR51E2CYP3A4CYP2C8 | |
| SCHEMBL28603859 | 0.73 | ALOX5 (0.41) | IMPDH2ALOX5OR51E2CYP3A4CYP1A2 | |
| SCHEMBL11095430 | 0.70 | CYP3A4 (0.56) | ALOX5CYP3A4ALDH1A1 | |
| SCHEMBL25381773 | 0.69 | FASN (0.61) | CYP3A4ALDH1A1FASN | |
| SCHEMBL23692777 | 0.68 | KMT2A (0.55) | ALOX5OR51E2 | |
| SCHEMBL18396941 | 0.68 | IAPP (0.69) | IAPPALOX5OR51E2CYP3A4CYP2C8 |
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 |