Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.69 |
| ▸ | HTR2A | P28223 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | METAP1 | P53582 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9370726 | 0.85 | ALDH1A1 (0.54) | ALDH1A1KMT2AKDM4EMEN1MAPT | |
| SCHEMBL15774873 | 0.84 | KMT2A (0.64) | ALDH1A1KMT2AKDM4EMEN1MAPT | |
| SCHEMBL15774975 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KMT2AKDM4EHTR2AHTR2C | |
| SCHEMBL344573 | 0.82 | CYP19A1 (0.50) | ALDH1A1KMT2AKDM4EHTR2AHTR2C | |
| SCHEMBL344572 | 0.82 | CYP19A1 (0.50) | ALDH1A1KMT2AKDM4EHTR2AHTR2C | |
| SCHEMBL4730776 | 0.81 | ALDH1A1 (0.70) | ALDH1A1KMT2AKDM4EMEN1MAPT | |
| SCHEMBL9344657 | 0.80 | ALDH1A1 (0.61) | ALDH1A1KMT2AKDM4EMEN1MAPT | |
| SCHEMBL630214 | 0.78 | DRD2 (0.51) | ALDH1A1KMT2AKDM4EDRD2MEN1 | |
| SCHEMBL9688032 | 0.78 | MTNR1A (0.54) | ALDH1A1KMT2AKDM4EDRD2MEN1 | |
| SCHEMBL7289390 | 0.78 | DRD2 (0.51) | ALDH1A1KMT2AKDM4EDRD2MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014086697-A1 | SUBSTITUTED THIAZOLE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2014-06-12 | — | — | WO | disclosed |
| US-5308852-A | Cardiovascular disorders | MERCK FROSST CANADA, INC. (CA) | 1994-05-03 | — | — | US | disclosed |
| EP-0579304-A1 | Heteroarylnaphthalenes as inhibitors of leukotriene biosynthesis | MERCK FROSST CANADA INC. (CA) | 1994-01-19 | — | — | EP | disclosed |
| WO-1994000444-A1 | HETEROARYLNAPHTHALENES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS | MERCK FROSST CANADA INC. (CA) | 1994-01-06 | — | — | WO | disclosed |