Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.45 |
| ▸ | TSHR | P16473 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.41 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.41 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TERT | O14746 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL143348 | 0.83 | CYP2A6 (0.48) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL2845185 | 0.79 | ALDH1A1 (0.58) | ALDH1A1TSHRMAPTKDM4EGAA | |
| SCHEMBL4401250 | 0.78 | ERN1 (0.52) | CYP2A6CYP2A13 | |
| SCHEMBL3176178 | 0.78 | CYP2A6 (0.47) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL15982250 | 0.78 | CYP2A6 (0.47) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL9756582 | 0.78 | CYP2A6 (0.47) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL29954002 | 0.78 | ERN1 (0.52) | CYP2A6CYP2A13 | |
| SCHEMBL14741400 | 0.76 | CYP2A6 (0.45) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL27994638 | 0.76 | CYP2A6 (0.45) | CYP2A6CYP2A13ALDH1A1TSHRMAPT | |
| SCHEMBL7671562 | 0.75 | CYP2A6 (0.48) | CYP2A6CYP2A13ALDH1A1TSHRMAPT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008137102-A2 | METHODS OF MODULATING AMYLOID BETA AND COMPOUNDS USEFUL THEREFOR | TORREYPINES THERAPEUTICS, INC. (US) | 2008-11-13 | — | — | WO | disclosed |
| EP-0465155-B1 | Non-linear optical material containing steroidal ketone compound | HITACHI CHEMICAL CO LTD (JP) | 1996-02-28 | — | — | EP | disclosed |
| US-5443758-A | A ketone cis- or trans-gonanes; nonlinear optical response | HATACHI CHEMICAL COMPANY, LTD. (JP) | 1995-08-22 | — | — | US | disclosed |
| US-5262090-A | Electrooptical switches | HITACHI CHEMICAL COMPANY, LTD. (JP) | 1993-11-16 | — | — | US | disclosed |
| EP-0465155-A2 | Non-linear optical material containing steroidal ketone compound | Hitachi Chemical Co., Ltd. (JP) | 1992-01-08 | — | — | EP | disclosed |
| US-4368335-A | N'-(2,6-Dichloro-4-(substituted-benzylamino)phenyl)-N,N-dimethyl-formamidines | AMERICAN CYANAMID COMPANY (US) | 1983-01-11 | — | — | US | disclosed |
| US-4360466-A | N'-[2,6-Dichloro-4-(substituted-benzylideneamino)phenyl]-N,N-dimethylformamidines | AMERICAN CYANAMID COMPANY (US) | 1982-11-23 | — | — | US | disclosed |