Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GUSB | P08236 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9475589 | 0.85 | KIF11 (0.53) | ALDH1A1LMNAMAPTATMCACNA1F | |
| SCHEMBL9871999 | 0.82 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTNPSR1ATM | |
| SCHEMBL9475626 | 0.80 | CACNA1F (0.49) | ALDH1A1LMNAMAPTNPSR1CACNA1F | |
| SCHEMBL9475421 | 0.78 | ALDH1A1 (0.48) | ALDH1A1MAPTATMCACNA1FCACNA1D | |
| SCHEMBL9475155 | 0.77 | ALDH1A1 (0.50) | ALDH1A1ATMCACNA1FCACNA1DCACNA1S | |
| SCHEMBL9476049 | 0.75 | CACNA1F (0.64) | ALDH1A1LMNAMAPTNPSR1CACNA1F | |
| SCHEMBL9474962 | 0.74 | CACNA1F (0.63) | ALDH1A1LMNAMAPTNPSR1CACNA1F | |
| SCHEMBL9475842 | 0.74 | CACNA1F (0.47) | ALDH1A1LMNAMAPTNPSR1CACNA1F | |
| SCHEMBL9475783 | 0.73 | LMNA (0.55) | ALDH1A1LMNAMAPTCACNA1FCACNA1D | |
| SCHEMBL27517088 | 0.73 | KDM4E (0.68) | ALDH1A1LMNAMAPTNPSR1CACNA1D |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5202330-A | Hypotensive and cardiovascular agent, reduces blood pressure in mammals | E. R. SQUIBB & SONS, INC. (US) | 1993-04-13 | — | — | US | disclosed |
| EP-0204317-A2 | 2-Thio or oxo-4-aryl or heterocyclo-1,5(2H)-pyrimidinedicarboxylic acid diesters and 3-acyl-5-pyrimidinecarboxylic acids and esters | E.R. Squibb & Sons, Inc. (US) | 1986-12-10 | — | — | EP | disclosed |