Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 5/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18954460 | 0.93 | ALDH1A1 (0.47) | ALDH1A1MAPTHTTHSD17B10LMNA | |
| SCHEMBL18954556 | 0.86 | ALDH1A1 (0.57) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL18954588 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL18954676 | 0.81 | ALDH1A1 (0.56) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL18954700 | 0.79 | ALDH1A1 (0.47) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL18954759 | 0.79 | PARK7 (0.50) | ALDH1A1MAPTHTTHSD17B10ALDH2 | |
| SCHEMBL16047437 | 0.78 | ALDH1A1 (0.49) | ALDH1A1ALDH2ALDH3A1CASP3CASP7 | |
| SCHEMBL18954538 | 0.77 | ALDH1A1 (0.46) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL11148681 | 0.76 | ALDH1A1 (0.48) | ALDH1A1MAPTHSD17B10ALDH2ALDH3A1 | |
| SCHEMBL18954749 | 0.76 | ALDH1A1 (0.57) | ALDH1A1MAPTHTTHSD17B10ALDH3A1 |
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 |