Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | CASP3 | P42574 | 9/20 | 0.47 |
| ▸ | CASP7 | P55210 | 9/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.43 |
| ▸ | CASP6 | P55212 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18955348 | 0.93 | ALDH1A1 (0.53) | ALDH1A1CASP3CASP7MAPTHTT | |
| SCHEMBL18955305 | 0.88 | ALDH1A1 (0.55) | ALDH1A1CASP3CASP7MAPTHTT | |
| SCHEMBL18955049 | 0.88 | CA1 (0.56) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL18955210 | 0.88 | ALDH1A1 (0.71) | ALDH1A1CASP3CASP7MAPTHTT | |
| SCHEMBL18954856 | 0.83 | CASP3 (0.57) | CASP3CASP7CASP6CA12CA1 | |
| SCHEMBL18955128 | 0.82 | ALDH1A1 (0.58) | ALDH1A1CASP3MAPTHTTHSD17B10 | |
| SCHEMBL18955190 | 0.82 | CA1 (0.54) | ALDH1A1CASP3CASP7CA12CA1 | |
| SCHEMBL18955347 | 0.82 | ALDH1A1 (0.53) | ALDH1A1CASP3CASP7MAPTHTT | |
| SCHEMBL18954765 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MAPTHTTHSD17B10MEN1 | |
| SCHEMBL18974747 | 0.79 | CES1 (0.59) | ALDH1A1MAPTHTTHSD17B10KMT2A |
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-2017099695-A1 | N-[(AMINOSULFONYL)PHENYL]-2-(1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)-HYDRAZINECARBOTHIOAMIDE DERIVATIVES FOR TREATING CANCER AND IMMUNOLOGICAL DISORDERS | ISTANBUL UNIVERSITESI REKTORLUGU (TR) | 2017-06-15 | — | — | WO | disclosed |