Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 4/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.37 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27507076 | 1.00 | ESR1 (0.38) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27489430 | 0.99 | TAS1R3 (0.39) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27555996 | 0.99 | TAS1R3 (0.39) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27506653 | 0.99 | TAS1R3 (0.39) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27487730 | 0.99 | ITGB1 (0.39) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27506254 | 0.98 | TAS1R3 (0.40) | ESR1THRBITGB1ITGA4NAAA | |
| SCHEMBL27486995 | 0.91 | TAS1R3 (0.40) | ITGB1ITGA4TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL27523495 | 0.90 | TAS1R3 (0.42) | TAS1R3TAS1R1TAS1R2EPHX2NR1I2 | |
| SCHEMBL27507489 | 0.87 | TAS1R3 (0.43) | TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL27487365 | 0.86 | TAS1R3 (0.45) | TAS1R3TAS1R1TAS1R2EPHX2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-1198831-C | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2005-04-27 | — | — | CN | disclosed |
| CN-1329005-A | Organic metal monoacylalkylphosphine compound | CIBA SC HOLDING AG (CH) | 2002-01-02 | — | — | CN | disclosed |