Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | EDNRB | P24530 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7808396 | 0.83 | EDNRB (0.45) | SMN1; SMN2ALDH1A1LMNATDP1CYP1A2 | |
| SCHEMBL12095218 | 0.83 | EDNRB (0.45) | SMN1; SMN2ALDH1A1LMNATDP1CYP1A2 | |
| SCHEMBL9723427 | 0.81 | SMN1; SMN2 (0.47) | SMN1; SMN2MAPTNPSR1ALDH1A1MEN1 | |
| SCHEMBL21318822 | 0.68 | ALDH1A1 (0.38) | SMN1; SMN2MAPTNPSR1HTTALDH1A1 | |
| SCHEMBL7920432 | 0.68 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1MEN1KMT2AABCB1 | |
| SCHEMBL14804671 | 0.68 | ALDH1A1 (0.38) | SMN1; SMN2MAPTNPSR1HTTALDH1A1 | |
| SCHEMBL12951613 | 0.68 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1MEN1KMT2AABCB1 | |
| SCHEMBL9019908 | 0.67 | TAS1R3 (0.35) | MAPTNPSR1HTTCYP1A2POLB | |
| SCHEMBL14325441 | 0.67 | EDNRB (0.52) | ALDH1A1LMNATDP1EDNRBEDNRA | |
| SCHEMBL7825117 | 0.67 | EDNRB (0.52) | ALDH1A1LMNATDP1EDNRBEDNRA |
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-5139563-A | HERBICIDAL COMPOUNDS | SHELL RESEARCH LIMITED (GB) | 1992-08-18 | — | — | US | disclosed |
| EP-0400741-A1 | Herbicidal compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-12-05 | — | — | EP | disclosed |