Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL31203581 | 0.98 | NPC1 (0.42) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL25337616 | 0.84 | PNMT (0.41) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28507360 | 0.83 | NPC1 (0.41) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL30298691 | 0.83 | NPC1 (0.41) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL6256393 | 0.82 | PGR (0.43) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29177673 | 0.81 | PGR (0.42) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL30103698 | 0.81 | PGR (0.42) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL22289807 | 0.79 | NPC1 (0.44) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL20502811 | 0.79 | PGR (0.38) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL18343744 | 0.79 | NPC1 (0.37) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 |
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-108047235-B | A kind of aromatic heterocyclic compounds and its application | 西安瑞联新材料股份有限公司 | 2019-10-18 | — | — | CN | disclosed |
| CN-108047235-A | A kind of aromatic heterocyclic compounds and its application | 西安瑞联新材料股份有限公司 | 2018-05-18 | — | — | CN | disclosed |