Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ERN1 | O75460 | 7/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | STAT6 | P42226 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9798217 | 0.86 | ERN1 (0.43) | ALDH1A1TSHRERN1HTTLMNA | |
| SCHEMBL4273991 | 0.79 | VCAM1 (0.54) | ALDH1A1ERN1HTTLMNA | |
| SCHEMBL9664960 | 0.76 | TDP1 (0.60) | ALDH1A1TSHRERN1LMNATDP1 | |
| SCHEMBL2556452 | 0.74 | ERN1 (0.50) | ALDH1A1ERN1TDP1 | |
| SCHEMBL28811341 | 0.73 | DPP4 (0.42) | ALDH1A1ERN1HTTLMNASMN1; SMN2 | |
| SCHEMBL9798503 | 0.73 | ALDH1A1 (0.34) | ALDH1A1HTTHPGDCYP1A2CYP3A4 | |
| SCHEMBL9192573 | 0.73 | ALDH1A1 (0.40) | ALDH1A1ERN1TDP1SOS1TP53 | |
| SCHEMBL7907202 | 0.71 | ALDH1A1 (0.51) | ALDH1A1ERN1LMNASMN1; SMN2TDP1 | |
| SCHEMBL4281290 | 0.71 | L3MBTL1 (0.56) | ALDH1A1TDP1HPGDMAPK1 | |
| SCHEMBL6210201 | 0.71 | ERN1 (0.58) | ALDH1A1ERN1HTTLMNASMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-5120845-A | Treating congestive heart failure | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-06-09 | — | — | US | disclosed |
| US-5043327-A | Treating mammals with congestive heart failure | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-08-27 | — | — | US | disclosed |