Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CMA1 | P23946 | 8/20 | 0.43 |
| ▸ | CTSG | P08311 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HTR2B | P41595 | 4/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CCNC | P24863 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | NFATC1 | O95644 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL18509808 | 0.90 | PTGER1 (0.50) | CMA1CTSGHTR2CHTR2BHTR2A | |
| SCHEMBL21392220 | 0.81 | MCL1 (0.55) | CMA1CTSGMCL1PTGER1PTGER4 | |
| SCHEMBL18029128 | 0.80 | ALDH1A1 (0.44) | CMA1HTTNFATC1GSK3BDYRK1A | |
| SCHEMBL20119869 | 0.79 | HTR2C (0.63) | CMA1CTSGHTR2CHTR2BHTR2A | |
| SCHEMBL21392216 | 0.79 | CMA1 (0.64) | CMA1CTSGHTR2CHTR2BHTR2A | |
| SCHEMBL20120023 | 0.78 | EGFR (0.41) | MCL1HTTHDAC6 | |
| SCHEMBL18509533 | 0.78 | MCL1 (0.51) | CMA1CTSGMCL1HTR2CHTR2B | |
| SCHEMBL20120027 | 0.78 | CMA1 (0.47) | CMA1CTSGHTR2CHTR2BHTR2A | |
| SCHEMBL18509797 | 0.78 | CMA1 (0.47) | CMA1CTSGHTR2CHTR2BHTR2A | |
| SCHEMBL18509674 | 0.78 | CMA1 (0.47) | CMA1CTSGHTR2CHTR2BHTR2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019183358-A2 | WHOLE CELL PROCESSES TO PRODUCE NITROAROMATICS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2019-09-26 | — | — | WO | disclosed |