Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.76 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.52 |
| ▸ | PIN4 | Q9Y237 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | CTRC | Q99895 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18955128 | 0.87 | ALDH1A1 (0.58) | ALDH1A1MAPTHTTHSD17B10CASP3 | |
| SCHEMBL18955310 | 0.85 | ALDH1A1 (0.56) | ALDH1A1MAPTHTTHSD17B10CASP3 | |
| SCHEMBL27703276 | 0.84 | ALDH1A1 (0.76) | ALDH1A1MAPTHTTHSD17B10PIN1 | |
| SCHEMBL12674685 | 0.84 | ALDH1A1 (0.76) | ALDH1A1MAPTHTTHSD17B10PIN1 | |
| SCHEMBL18955251 | 0.83 | ALDH1A1 (0.75) | ALDH1A1MAPTHSD17B10CASP3CUL4A | |
| SCHEMBL18955121 | 0.83 | ALDH1A1 (0.53) | ALDH1A1CASP3CUL4AAGTR1CES1 | |
| SCHEMBL18954711 | 0.82 | ALDH1A1 (0.73) | ALDH1A1MAPTHTTHSD17B10PIN1 | |
| SCHEMBL18954768 | 0.82 | ALDH1A1 (0.73) | ALDH1A1MAPTHTTHSD17B10PIN1 | |
| SCHEMBL18955210 | 0.81 | ALDH1A1 (0.71) | ALDH1A1MAPTHTTHSD17B10PIN1 | |
| SCHEMBL18955209 | 0.81 | ALDH1A1 (0.71) | ALDH1A1MAPTHTTHSD17B10PIN1 |
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 |