Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31050347 | 0.77 | KDM4E (0.40) | TSHRTDP1L3MBTL1 | |
| SCHEMBL833974 | 0.77 | KDM4E (0.40) | TSHRTDP1L3MBTL1 | |
| SCHEMBL514267 | 0.73 | POLB (0.41) | TSHRALDH1A1TDP1L3MBTL1SLC6A4 | |
| SCHEMBL31096212 | 0.73 | TSHR (0.45) | TSHRALDH1A1TDP1 | |
| SCHEMBL21823446 | 0.73 | TSHR (0.45) | TSHRALDH1A1TDP1 | |
| SCHEMBL6867559 | 0.73 | HRH4 (0.38) | CCR2MAPK1TSHRALDH1A1TDP1 | |
| SCHEMBL2653805 | 0.71 | HRH4 (0.38) | MAPK1TSHRALDH1A1TDP1L3MBTL1 | |
| SCHEMBL10467229 | 0.71 | MAPK1 (0.58) | MAPK1TSHRALDH1A1TDP1L3MBTL1 | |
| SCHEMBL3107273 | 0.69 | ALDH1A1 (0.38) | CCR2MAPK1TSHRALDH1A1TDP1 | |
| SCHEMBL1456050 | 0.69 | GAA (0.33) | MAPK1TSHRALDH1A1L3MBTL1 |
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-1100803-A2 | PYRROLO 2,1-B] 1,3]BENZOTHIAZEPINES WITH ATYPICAL ANTIPSYCHOTIC ACTIVITY | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000006579-A2 | PYRROLO[2,1-B][1,3]BENZOTHIAZEPINES WITH ATYPICAL ANTIPSYCHOTIC ACTIVITY | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2000-02-10 | — | — | WO | disclosed |