Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.57 |
| ▸ | HPGD | P15428 | 8/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.57 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 5/20 | 0.50 |
| ▸ | CASP1 | P29466 | 4/20 | 0.50 |
| ▸ | CASP7 | P55210 | 4/20 | 0.50 |
| ▸ | GLA | P06280 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL9227378 | 0.83 | MCL1 (0.58) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4929370 | 0.78 | CA9 (0.61) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8359237 | 0.77 | MCL1 (1.00) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL4931518 | 0.75 | ALDH1A1 (0.52) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| 4,6,7-Trimethyl-2H-Chromen-2-One SCHEMBL19049403 | 0.74 | KDM4E (0.68) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9229347 | 0.73 | KDM4E (0.60) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL409482 | 0.73 | MCL1 (1.00) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| 4-Methylesculetin SCHEMBL29361762 | 0.73 | MCL1 (1.00) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11442137 | 0.72 | MCL1 (0.72) | MCL1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28061597 | 0.72 | MCL1 (0.72) | MCL1KDM4EALDH1A1HPGDHSD17B10 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5439828-A | Fluorgenic and chomogenic three-dimensional ionophores as selective reagents for detecting ions in biological fluids | ALLIEDSIGNAL INC. (US) | 1995-08-08 | — | — | US | disclosed |
| EP-0371992-B1 | IONOPHORES AS REAGENTS FOR DETECTING IONS | ALLIED SIGNAL INC (US) | 1995-05-17 | — | — | EP | disclosed |
| US-5162525-A | FLUOROGENIC AND CHROMOGENIC THREE-DIMENSIONAL IONOPHORES AS SELECTIVE REAGENTS FOR DETECTING IONS IN BIOLOGICAL FLUIDS | ALLIED-SIGNAL INC. (US) | 1992-11-10 | — | — | US | disclosed |
| EP-0371992-A1 | IONOPHORES AS REAGENTS FOR DETECTING IONS. | ALLIED SIGNAL INC (US) | 1990-06-13 | — | — | EP | disclosed |
| WO-1989000997-A1 | IONOPHORES AS REAGENTS FOR DETECTING IONS | ALLIED-SIGNAL INC. (US) | 1989-02-09 | — | — | WO | disclosed |