Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TNF | P01375 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8092354 | 0.81 | — | — | |
| SCHEMBL10871776 | 0.78 | ALDH1A1 (0.38) | ALDH1A1ESR1HPGDHSD17B10SOAT1 | |
| SCHEMBL6826099 | 0.75 | ADORA2A (0.43) | ALDH1A1HPGDADORA3ADORA2AADORA1 | |
| SCHEMBL7016518 | 0.68 | ALDH1A1 (0.40) | ALDH1A1HPGDHSD17B10KDM4ETDP1 | |
| SCHEMBL7013807 | 0.68 | ALDH1A1 (0.48) | ALDH1A1HPGDHSD17B10SOAT1CA2 | |
| SCHEMBL7018030 | 0.67 | ALDH1A1 (0.39) | ALDH1A1SOAT1ADORA3ADORA2AADORA1 | |
| SCHEMBL10918321 | 0.66 | ALDH1A1 (0.38) | ALDH1A1HPGDSOAT1KDM4ESMN1; SMN2 | |
| SCHEMBL6822701 | 0.65 | MAPK1 (0.32) | KDM4ESMN1; SMN2 | |
| SCHEMBL1577573 | 0.64 | ALDH1A1 (0.43) | ALDH1A1HPGDHSD17B10SOAT1CA2 | |
| SCHEMBL10511469 | 0.63 | ALDH1A1 (0.46) | ALDH1A1HPGDHSD17B10SOAT1CA2 |
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-1051431-A1 | THROMBIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999037668-A1 | THROMBIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-07-29 | — | — | WO | disclosed |