Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CMA1 | P23946 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.43 |
| ▸ | PTGIR | P43119 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL2196195 | 0.98 | SIGMAR1 (0.46) | SIGMAR1ALDH1A1MAPTKDM4EALOX15 | |
| SCHEMBL15429645 | 0.89 | CMA1 (0.58) | SIGMAR1ALDH1A1MAPTKDM4EALOX15 | |
| Hydrochloric Acid SCHEMBL2530335 | 0.87 | CMA1 (0.56) | SIGMAR1ALDH1A1MAPTKDM4EALOX15 | |
| SCHEMBL15803245 | 0.87 | HRH3 (0.34) | ALDH1A1MAPTHRH3CHKALMNA | |
| SCHEMBL15803247 | 0.82 | HRH3 (0.43) | HRH3CHKA | |
| SCHEMBL12220197 | 0.81 | CMA1 (0.50) | SIGMAR1ALDH1A1MAPTKDM4EALOX15 | |
| Bromide SCHEMBL9661608 | 0.81 | SIGMAR1 (0.50) | SIGMAR1ALOX15GSK3AGSK3BHRH3 | |
| SCHEMBL1011075 | 0.81 | LPO (0.54) | SIGMAR1ALDH1A1MAPTKDM4ECMA1 | |
| SCHEMBL31177907 | 0.81 | LPO (0.54) | SIGMAR1ALDH1A1MAPTKDM4ECMA1 | |
| SCHEMBL28786436 | 0.81 | SMN1; SMN2 (0.33) | SIGMAR1ALDH1A1SMN1; SMN2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104781251-B | Can as kinase modulator through the substituted pyridinyl compounds of bicyclic heterocycle | 百时美施贵宝公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-104781251-A | Bicyclic heterocycle substituted pyridyl compounds useful as kinase modulators | BRISTOL MYERS SQUIBB CO | 2015-07-15 | — | — | CN | disclosed |
| EP-2268652-B1 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI SA (FR) | 2012-12-19 | — | — | EP | disclosed |
| EP-2268652-A2 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2011-01-05 | — | — | EP | disclosed |
| WO-2009118475-A2 | PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2009-10-01 | — | — | WO | disclosed |