Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9565886 | 0.85 | SRD5A2 (0.51) | ALDH1A1NPC1RAB9AKMT2ALMNA | |
| SCHEMBL11114179 | 0.85 | SRD5A2 (0.51) | CES2CES1NPC1RAB9AKMT2A | |
| SCHEMBL392840 | 0.84 | SMN1; SMN2 (0.63) | SMN1; SMN2TSHRCASP1CYP11B2ALDH1A1 | |
| SCHEMBL645757 | 0.84 | ALDH1A1 (0.54) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 | |
| SCHEMBL28072667 | 0.84 | ALDH1A1 (0.50) | SMN1; SMN2TSHRCASP1CES2CES1 | |
| SCHEMBL911253 | 0.83 | DGAT1 (0.60) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 | |
| SCHEMBL8162477 | 0.83 | SMN1; SMN2 (0.46) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 | |
| SCHEMBL29392929 | 0.83 | MAOB (0.58) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 | |
| SCHEMBL325429 | 0.83 | MAOB (0.58) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 | |
| SCHEMBL29150071 | 0.82 | TRPA1 (0.44) | SMN1; SMN2TSHRCASP1CYP11B2CYP11B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102232075-A | Aminopyrazole compounds | LILLY CO ELI | 2011-11-02 | — | — | CN | disclosed |
| CN-1139580-C | Substituted benzylamines and their use for the treatment of depression | ��˹��ŵ�� | 2004-02-25 | — | — | CN | disclosed |
| CN-1219169-A | Substituted benzylamines and their use for the treatment of depression | AKZO NOBEL NV (NL) | 1999-06-09 | — | — | CN | disclosed |