Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | DGKA | P23743 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL10749478 | 1.00 | GAA (0.46) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL10704454 | 0.95 | GAA (0.50) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL11703928 | 0.90 | DGKA (0.43) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL11704516 | 0.90 | DGKA (0.43) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL3688694 | 0.87 | ESR1 (0.45) | GAAESR1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL3250259 | 0.85 | GAA (0.49) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL14247167 | 0.84 | CNR2 (0.47) | DGKACNR2ALDH1A1 | |
| SCHEMBL9222165 | 0.83 | DGKA (0.43) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL9227927 | 0.83 | DGKA (0.43) | GAADGKAESR1AKR1C4AKR1C3 | |
| SCHEMBL9230031 | 0.83 | DGKA (0.43) | GAADGKAESR1AKR1C4AKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040030071-A1 | Method for polymerizing conjugated diolefins (dienes) with catalysts of rare earths in the presence of vinyl aromatic solvents | BAYER AKTIENGESELLSCHAFT (DE) | 2004-02-12 | — | — | US | disclosed |
| US-3931060-A | POLYURETHANE FOAM FREE FROM INTERNAL DISCOLORATION | BAYER AKTIENGESELLSCHAFT (DT) | 1976-01-06 | — | — | US | disclosed |