Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.45 |
| ▸ | MDH1 | P40925 | 1/20 | 0.44 |
| ▸ | MDH2 | P40926 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 2/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL9361024 | 0.84 | MAPT (0.49) | MDH1MDH2MAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL8917612 | 0.84 | THRA (0.41) | THRATHRBMAPTCYP1A2CYP2C19 | |
| SCHEMBL8917633 | 0.82 | SLC9A1 (0.51) | — | |
| SCHEMBL8729586 | 0.78 | SMN1; SMN2 (0.57) | VCAM1MAPTSMN1; SMN2TSHRKDM4E | |
| SCHEMBL1503528 | 0.75 | MAPT (0.69) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL5356041 | 0.74 | MAPT (0.54) | MAPTSMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL21081092 | 0.73 | VCAM1 (0.51) | VCAM1MAPTSMN1; SMN2CYP1A2TSHR | |
| SCHEMBL19639432 | 0.72 | RARA (0.67) | MDH1MDH2RARGRARARARB | |
| SCHEMBL1055820 | 0.72 | MAPT (0.54) | MDH1MDH2MAPTSMN1; SMN2CYP1A2 | |
| SCHEMBL9360552 | 0.72 | ALDH1A1 (0.50) | MAPTSMN1; SMN2CYP1A2CYP2C19RARG |
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-5670544-A | ANTIISCHEMIC AGENTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-09-23 | — | — | US | disclosed |