Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TPMT | P51580 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | SELL | P14151 | 1/20 | 0.36 |
| ▸ | SELP | P16109 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | C1S | P09871 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28802212 | 0.84 | ALDH1A1 (0.57) | ALDH1A1TSHRACHESELLSELP | |
| SCHEMBL13408651 | 0.84 | TRPA1 (0.37) | ALDH1A1ACHESELLSELPSELE | |
| SCHEMBL3584509 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL13677507 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL1721607 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL14469274 | 0.79 | ALDH1A1 (0.43) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL27691075 | 0.77 | ALDH1A1 (0.41) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL19111818 | 0.77 | ALDH1A1 (0.41) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL13678524 | 0.77 | ALDH1A1 (0.43) | ALDH1A1TSHRTPMTACHESELL | |
| SCHEMBL27919227 | 0.77 | TPMT (0.64) | ALDH1A1TSHRTPMTSELLSELP |
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 |
|---|---|---|---|---|---|---|---|
| US-5166398-A | Anticholesterol agents or atherosclerosis | WARNER-LAMBERT CO. (US) | 1992-11-24 | — | — | US | disclosed |