Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.79 |
| ▸ | HPGD | P15428 | 4/20 | 0.79 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.79 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.79 |
| ▸ | PKM | P14618 | 1/20 | 0.79 |
| ▸ | FBP1 | P09467 | 3/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.61 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.61 |
| ▸ | DRD2 | P14416 | 1/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.61 |
| ▸ | DRD1 | P21728 | 1/20 | 0.61 |
| ▸ | MC5R | P33032 | 1/20 | 0.61 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.61 |
| ▸ | DRD3 | P35462 | 1/20 | 0.61 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.61 |
| ▸ | CCR2 | P41597 | 1/20 | 0.61 |
| ▸ | HTR6 | P50406 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL8203421 | 1.00 | ALDH1A1 (0.79) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL30514153 | 0.93 | ALDH1A1 (0.75) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL1412338 | 0.93 | ALDH1A1 (0.75) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL11545638 | 0.92 | ALDH1A1 (0.73) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL10794271 | 0.92 | ALDH1A1 (0.73) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL29404281 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL79658 | 0.89 | ALDH1A1 (1.00) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL11815070 | 0.86 | ALDH1A1 (0.66) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL11882398 | 0.83 | ALDH1A1 (0.68) | ALDH1A1HPGDHSD17B10ALOX15KDM4E | |
| SCHEMBL11549553 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HPGDHSD17B10ALOX15KDM4E |
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-6310158-B1 | MODIFIED BUTYL RUBBER | THE YOKOHAMA RUBBER CO., LTD. (JP) | 2001-10-30 | — | — | US | disclosed |