Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | PPOX | P50336 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | PARK7 | Q99497 | 2/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | PIN4 | Q9Y237 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18954538 | 0.93 | ALDH1A1 (0.46) | ALDH1A1KAT2BLMNAMAPTHTT | |
| SCHEMBL18954631 | 0.78 | PARK7 (0.58) | ALDH1A1LMNAMAPTHSD17B10GSK3A | |
| SCHEMBL28527361 | 0.76 | CES1 (0.43) | ALDH1A1MAPTMEN1KMT2APARK7 | |
| SCHEMBL18955128 | 0.76 | ALDH1A1 (0.58) | ALDH1A1LMNAMAPTHTTHSD17B10 | |
| SCHEMBL18954460 | 0.76 | ALDH1A1 (0.47) | ALDH1A1KAT2BLMNAMAPTHTT | |
| SCHEMBL18954706 | 0.75 | ALDH1A1 (0.43) | ALDH1A1MAPTHTTHSD17B10MEN1 | |
| SCHEMBL18954505 | 0.75 | ALDH1A1 (0.61) | ALDH1A1LMNAMAPTHTTHSD17B10 | |
| SCHEMBL18954742 | 0.75 | PPOX (0.39) | ALDH1A1LMNAMAPTHTTHSD17B10 | |
| SCHEMBL18974747 | 0.75 | CES1 (0.59) | ALDH1A1MAPTHTTHSD17B10KMT2A | |
| SCHEMBL18954583 | 0.74 | ALDH1A1 (0.47) | ALDH1A1MAPTHTTHSD17B10MEN1 |
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 |