Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8195522 | 0.80 | TAAR1 (0.48) | ALDH1A1SMN1; SMN2TP53ALOX15MEN1 | |
| SCHEMBL5929477 | 0.78 | TP53 (0.52) | ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4 | |
| SCHEMBL3246350 | 0.77 | ACHE (0.56) | ALDH1A1AGXTTDP1LMNAKMT2A | |
| SCHEMBL150433 | 0.76 | NQO1 (0.52) | ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4 | |
| SCHEMBL12619631 | 0.75 | TP53 (0.50) | ALDH1A1TSHRTDP1CYP3A4MAPK1 | |
| SCHEMBL5099332 | 0.74 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4 | |
| SCHEMBL3246110 | 0.74 | WDR5 (0.54) | ALDH1A1SMN1; SMN2AGXTTDP1 | |
| SCHEMBL2094942 | 0.74 | TP53 (0.48) | ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4 | |
| SCHEMBL12749081 | 0.74 | TP53 (0.63) | ALDH1A1TSHRTDP1CYP3A4MAPK1 | |
| SCHEMBL3162047 | 0.74 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2426492-A1 | AGENT FOR RESOLUTION OF OPTICAL ISOMER | Daicel Chemical Industries, Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |