Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3392935 | 0.99 | MAPT (0.37) | MAPTALDH1A1SMN1; SMN2HPGDNPC1 | |
| SCHEMBL2335862 | 0.95 | MAPT (0.37) | MAPTALDH1A1SMN1; SMN2HPGDNPC1 | |
| SCHEMBL123690 | 0.80 | ALDH1A1 (0.43) | MAPTALDH1A1SMN1; SMN2NPC1CYP3A4 | |
| SCHEMBL10527285 | 0.79 | CYP19A1 (0.42) | MAPTALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL28401883 | 0.76 | KDM4E (0.39) | MAPTALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL13673810 | 0.74 | MEN1 (0.47) | MAPTALDH1A1SMN1; SMN2HPGDNPC1 | |
| SCHEMBL21808035 | 0.72 | HTT (0.38) | MAPTALDH1A1SMN1; SMN2CYP3A4LMNA | |
| SCHEMBL28738082 | 0.72 | HTT (0.38) | MAPTALDH1A1CYP3A4HTT | |
| SCHEMBL31633553 | 0.72 | ALDH1A1 (0.68) | MAPTALDH1A1SMN1; SMN2HPGDCYP3A4 | |
| SCHEMBL1356676 | 0.72 | ALDH1A1 (0.47) | MAPTALDH1A1SMN1; SMN2CYP3A4LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2358719-B1 | Novel pyrrolo[2,1-c][1,4]benzodiazepine derivatives with dithiocarbamate side chains and process for the preparation thereof | COUNCIL SCIENT IND RES (IN) | 2014-10-01 | — | — | EP | disclosed |
| WO-2010058414-A1 | NOVEL PYRROIOL2,L-CU1.41BENZODIAZEPINE DERIVATIVES WITH DITHIOCARBAMATE SIDE CHAINS AND PROCESS FOR THE PREPARATION THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2010-05-27 | — | — | WO | disclosed |