Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.97 |
| ▸ | HPGD | P15428 | 5/20 | 0.97 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.97 |
| ▸ | TXN | P10599 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | FBP1 | P09467 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL80270 | 0.99 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL29658287 | 0.99 | ALDH1A1 (1.00) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL11445594 | 0.97 | ALDH1A1 (0.97) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL22607683 | 0.92 | ALDH1A1 (0.87) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL29003989 | 0.91 | ALDH1A1 (0.86) | ALDH1A1HPGDTDP1TXNNPC1 | |
| Guanidine SCHEMBL10893242 | 0.91 | ALDH1A1 (0.85) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL6290782 | 0.89 | ALDH1A1 (0.81) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL18398036 | 0.84 | ALDH1A1 (0.75) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL18407699 | 0.84 | ALDH1A1 (0.75) | ALDH1A1HPGDTDP1TXNNPC1 | |
| SCHEMBL30350291 | 0.84 | ALDH1A1 (0.75) | ALDH1A1HPGDTDP1TXNNPC1 |
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-0253365-A2 | Rubber composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-01-20 | — | — | EP | disclosed |
| EP-0004711-A2 | Process for the cross-linking of polymers | Vulnax International Limited (GB) | 1979-10-17 | — | — | EP | disclosed |