Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.76 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.76 |
| ▸ | MAPT | P10636 | 2/20 | 0.76 |
| ▸ | CASP1 | P29466 | 2/20 | 0.76 |
| ▸ | CASP7 | P55210 | 2/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.76 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.72 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.72 |
| ▸ | TSHR | P16473 | 1/20 | 0.72 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL2181196 | 0.97 | KDM4E (0.72) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL29581791 | 0.87 | ALDH1A1 (0.61) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| 3,7-Dihydroxyflavone SCHEMBL29625323 | 0.86 | CYP3A4 (1.00) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| 3,7-Dihydroxyflavone SCHEMBL2396684 | 0.86 | CYP3A4 (1.00) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL27717859 | 0.86 | KDM4E (0.74) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL28272747 | 0.84 | KDM4E (0.74) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL27952154 | 0.84 | CYP3A4 (0.74) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL1627835 | 0.84 | ALDH1A1 (1.00) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL27940008 | 0.84 | KDM4E (0.74) | MEN1KMT2AKDM4ECYP3A4MAPT | |
| SCHEMBL5266910 | 0.84 | ALDH1A1 (1.00) | MEN1KMT2AKDM4ECYP3A4MAPT |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6255497-B1 | DAIDZIN DERIVATIVES AS ENZYME INHIBITORS OF ALDEHYDE DEHYDROGENASE; USEFUL IN TREATING ALCOHOLISM | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY, INC. | 2001-07-03 | — | — | US | disclosed |
| US-5886028-A | REDUCING ALCOHOL CONSUMPTION BY ADMINISTERING AN ENZYME INHIBITOR | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY, INC. (US) | 1999-03-23 | — | — | US | disclosed |
| US-5624910-A | INHIBITING ALDEHYDE DEHYRDOGENASE ACTIVITY USING DAIDZIN | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY, INC. (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0592583-A1 | METHOD FOR THE INHIBITION OF ALDH-I USEFUL IN THE TREATMENT OF ALCOHOL DEPENDENCE OR ALCOHOL ABUSE | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY, INC. (US) | 1994-04-20 | — | — | EP | disclosed |
| US-5204369-A | METHOD FOR THE INHIBITION OF ALDH-I USEFUL IN THE TREATMENT OF ALCOHOL DEPENDENCE OR ALCOHOL ABUSE | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY (US) | 1993-04-20 | — | — | US | disclosed |
| WO-1993000896-A1 | METHOD FOR THE INHIBITION OF ALDH-I USEFUL IN THE TREATMENT OF ALCOHOL DEPENDENCE OR ALCOHOL ABUSE | THE ENDOWMENT FOR RESEARCH IN HUMAN BIOLOGY, INC. (US) | 1993-01-21 | — | — | WO | disclosed |
| EP-0064165-B1 | ANTIHYPERTENSIVE AGENTS | PENNWALT CORPORATION (US) | 1987-06-10 | — | — | EP | disclosed |
| US-4668805-A | HYPOTENSIVE AGENTS | PENNWALT CORPORATION (US) | 1987-05-26 | — | — | US | disclosed |
| US-4495198-A | ELIMINATION OF BETA-BLOCKING ACTIVITY | PENNWALT CORPORATION (US) | 1985-01-22 | — | — | US | disclosed |
| EP-0064165-A1 | Antihypertensive agents | PENNWALT CORPORATION (US) | 1982-11-10 | — | — | EP | disclosed |