Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29484197 | 1.00 | ACHE (0.49) | ACHECA1CA2CA12CA9 | |
| SCHEMBL7834997 | 0.76 | CACNA1D (0.51) | ACHECA1CA2CA12CA9 | |
| SCHEMBL29484200 | 0.76 | MEN1 (0.45) | KMT2ASMN1; SMN2MAPTALDH1A1HTT | |
| SCHEMBL29484199 | 0.76 | MEN1 (0.45) | KMT2ASMN1; SMN2MAPTALDH1A1HTT | |
| SCHEMBL29484198 | 0.76 | MEN1 (0.45) | KMT2ASMN1; SMN2MAPTALDH1A1HTT | |
| SCHEMBL29484194 | 0.76 | OPRM1 (0.48) | ACHEKMT2ASMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL7817217 | 0.74 | CA1 (0.60) | ACHECA1CA2CA12CA9 | |
| SCHEMBL29484195 | 0.74 | ALDH1A1 (0.54) | ACHEKMT2ASMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL28669986 | 0.74 | ALDH1A1 (0.72) | ACHEKMT2ASMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL29484202 | 0.71 | OPRD1 (0.44) | KMT2ASMN1; SMN2MAPTCYP3A4CYP2C9 |
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-111875591-B | Method for catalytic synthesis of drug intermediate 3-benzo [ d ] imidazole benzopyrone derivative | 马鞍山市泰博化工科技有限公司 | 2022-03-15 | — | — | CN | disclosed |