Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.44 |
| ▸ | HTR1B | P28222 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1593235 | 0.82 | SIGMAR1 (0.43) | SIGMAR1HTR1BCA12CA3CA4 | |
| SCHEMBL5931116 | 0.81 | SIGMAR1 (0.50) | SIGMAR1HTR1BCA12CA3CA4 | |
| SCHEMBL3132043 | 0.81 | SIGMAR1 (0.42) | SIGMAR1HTR1BCA12CA3CA4 | |
| SCHEMBL11705046 | 0.80 | SIGMAR1 (0.44) | SIGMAR1HTR1BALDH1A1TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL5679371 | 0.79 | SIGMAR1 (0.49) | SIGMAR1HTR1BCA12CA3CA4 | |
| SCHEMBL10401416 | 0.75 | MMP9 (0.47) | SIGMAR1HTR1BALDH1A1TSHRTDP1 | |
| SCHEMBL7962443 | 0.75 | SIGMAR1 (0.47) | SIGMAR1ALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL14461587 | 0.75 | SIGMAR1 (0.54) | SIGMAR1ALDH1A1TSHRHSD17B10CYP1A2 | |
| SCHEMBL28985641 | 0.72 | CARM1 (0.41) | SIGMAR1ALDH1A1TSHRHSD17B10CYP3A4 | |
| Hydrochloric Acid SCHEMBL3722949 | 0.72 | MMP9 (0.50) | SIGMAR1ALDH1A1TSHRHSD17B10RECQL |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2215101-A1 | CATIONIC TRANSITION METAL CATALYSTS | Kanata Chemical Technologies Inc. (CA) | 2010-08-11 | — | — | EP | claimed |
| WO-2009055912-A1 | CATIONIC TRANSITION METAL CATALYSTS | KANATA CHEMICAL TECHNOLOGIES INC. (CA) | 2009-05-07 | — | — | WO | claimed |
| CN-114478242-B | Salen-Ti complex catalyst and method for catalyzing asymmetric hydrogen atom transfer reaction by using same | 山东大学 | 2023-04-04 | — | — | CN | disclosed |
| CN-114478242-A | Salen-Ti complex catalyst and method for catalyzing asymmetric hydrogen atom transfer reaction by using same | 山东大学 | 2022-05-13 | — | — | CN | disclosed |
| US-4315031-A | Thiosubstituted amino acids | SCIENCE UNION ET CIE (FR) | 1982-02-09 | — | — | US | disclosed |
| US-4283407-A | ANTIHYPERTENSIVE AGENTS | SCIENCE UNION ET CIE (FR) | 1981-08-11 | — | — | US | disclosed |