Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 6/20 | 0.39 |
| ▸ | CA1 | P00915 | 6/20 | 0.39 |
| ▸ | CA2 | P00918 | 6/20 | 0.39 |
| ▸ | CA7 | P43166 | 6/20 | 0.39 |
| ▸ | CA9 | Q16790 | 6/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1726348 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL27643705 | 0.77 | KMT2A (0.47) | KMT2APIK3CDACACBALDH1A1NPC1 | |
| SCHEMBL26063409 | 0.76 | ACACB (0.34) | KMT2APIK3CDACACB | |
| SCHEMBL27408803 | 0.75 | ESR1 (0.47) | KMT2AACACBALDH1A1MAPTKDM4E | |
| SCHEMBL10044969 | 0.75 | PIK3CD (0.44) | KMT2APIK3CDACACBCSF1R | |
| SCHEMBL2650842 | 0.75 | — | — | |
| SCHEMBL28164379 | 0.75 | — | — | |
| SCHEMBL6368963 | 0.74 | ALDH1A1 (0.42) | KMT2APIK3CDACACBCA12CA1 | |
| SCHEMBL2614311 | 0.74 | ACACB (0.52) | KMT2APIK3CDACACBALDH1A1MAPK1 | |
| SCHEMBL290564 | 0.74 | CDC7 (0.49) | KMT2AACACBCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109689632-A | Substituted-amino thiazole | 巴鲁克斯布伦博格研究所 | 2019-04-26 | — | — | CN | disclosed |