Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 7/20 | 0.44 |
| ▸ | DRD3 | P35462 | 5/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD5 | P21918 | 2/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5574905 | 1.00 | ALDH1A1 (0.45) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL1546986 | 0.99 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| Hydrochloric Acid SCHEMBL1546989 | 0.99 | ALDH1A1 (0.44) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1545864 | 0.93 | DRD2 (0.52) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1545866 | 0.93 | DRD2 (0.52) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL5574178 | 0.93 | DRD2 (0.52) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1562657 | 0.92 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1546782 | 0.92 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1563862 | 0.92 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL1546905 | 0.92 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 |
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-1814849-A1 | HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | Abbott GmbH & Co. KG (DE) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006040182-A1 | HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR | ABBOTT GMBH & CO. KG (DE) | 2006-04-20 | — | — | WO | disclosed |