Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | GLA | P06280 | 2/20 | 0.52 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | CA9 | Q16790 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8491179 | 0.84 | MAOB (0.55) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL8491193 | 0.84 | MAOB (0.55) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL6276063 | 0.83 | AKR1C3 (0.55) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL8490315 | 0.83 | NQO1 (0.58) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL8493473 | 0.82 | KDM4E (0.56) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL6276774 | 0.81 | ALDH1A1 (0.49) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL6276971 | 0.80 | ALDH1A1 (0.53) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL8491236 | 0.80 | KDM4E (0.50) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL8494038 | 0.80 | KDM4E (0.50) | ALDH1A1KMT2AKDM4EGAAMAPT | |
| SCHEMBL8491240 | 0.80 | KDM4E (0.50) | ALDH1A1KMT2AKDM4EGAAMAPT |
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-5981495-A | TREATING HEART DISEASE BY ADMINISTERING TO THE HEART PATIENT A BENOPYRAN DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1999-11-09 | — | — | US | disclosed |
| EP-0796854-A1 | Benzopyran derivative and use of said benzopyran derivative for treating heart disease | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1997-09-24 | — | — | EP | disclosed |