Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHIT1 | Q13231 | 13/20 | 0.38 |
| ▸ | CHIA | Q9BZP6 | 13/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 9/20 | 0.38 |
| ▸ | CHI3L1 | P36222 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17838860 | 0.81 | CHIT1 (0.45) | CHIT1CHIAKCNH2 | |
| SCHEMBL17847353 | 0.79 | MEN1 (0.41) | CHIT1CHIAKCNH2CHI3L1MEN1 | |
| SCHEMBL17847364 | 0.76 | CHIT1 (0.50) | CHIT1CHIAKCNH2CHI3L1 | |
| SCHEMBL17838827 | 0.73 | KMT2A (0.47) | CHIT1CHIAMEN1KMT2AALDH1A1 | |
| SCHEMBL17838868 | 0.72 | CHIT1 (0.48) | CHIT1CHIAKCNH2 | |
| SCHEMBL17847361 | 0.72 | CHIT1 (0.49) | CHIT1CHIAKCNH2 | |
| SCHEMBL17853346 | 0.72 | PPARG (0.43) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL17838856 | 0.71 | PPARG (0.43) | ALDH1A1 | |
| SCHEMBL17838879 | 0.69 | STS (0.48) | MEN1KMT2A | |
| SCHEMBL17847358 | 0.68 | CHIT1 (0.51) | CHIT1CHIAKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3233832-A1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS ACIDIC MAMMALIAN CHITINASE INHIBITORS | ONCOARENDI THERAPEUTICS S.A. (PL) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016099311-A1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS ACIDIC MAMMALIAN CHITINASE INHIBITORS | OncoArendi Therapeutics Sp. z o.o. (PL) | 2016-06-23 | — | — | WO | disclosed |