Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.63 |
| ▸ | GAA | P10253 | 8/20 | 0.63 |
| ▸ | HPGD | P15428 | 8/20 | 0.63 |
| ▸ | GLA | P06280 | 7/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.63 |
| ▸ | CA12 | O43570 | 4/20 | 0.63 |
| ▸ | CA9 | Q16790 | 4/20 | 0.63 |
| ▸ | CASP1 | P29466 | 3/20 | 0.63 |
| ▸ | CASP7 | P55210 | 3/20 | 0.63 |
| ▸ | CA1 | P00915 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9296951 | 0.88 | ALDH1A1 (0.59) | KDM4EALDH1A1GAAHPGDGLA | |
| Acetic Acid SCHEMBL3998167 | 0.81 | ALDH1A1 (0.84) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL37677 | 0.79 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL28806970 | 0.79 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL29645144 | 0.79 | ALDH1A1 (1.00) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL7120862 | 0.78 | ALDH1A1 (0.61) | KDM4EALDH1A1GAAHPGDGLA | |
| Hydrochloric Acid SCHEMBL567469 | 0.78 | ALDH1A1 (0.96) | KDM4EALDH1A1GAAHPGDGLA | |
| Hydrochloric Acid SCHEMBL2545954 | 0.78 | ALDH1A1 (0.96) | KDM4EALDH1A1GAAHPGDGLA | |
| SCHEMBL1037558 | 0.78 | ALDH1A1 (0.96) | KDM4EALDH1A1GAAHPGDGLA | |
| Bromide SCHEMBL18007249 | 0.78 | ALDH1A1 (0.96) | KDM4EALDH1A1GAAHPGDGLA |
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-5580749-A | Internal reference for chemically modified spheres | GEORGIA TECH RESEARCH CORPORATION (US) | 1996-12-03 | — | — | US | disclosed |