Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.43 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.43 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9871017 | 1.00 | KMT2A (0.43) | KMT2AKDM4ESMN1; SMN2IP6K1IP6K3 | |
| SCHEMBL9871811 | 0.85 | HCAR2 (0.43) | KMT2ASMN1; SMN2CCNCCDK8L3MBTL1 | |
| SCHEMBL9871808 | 0.85 | HCAR2 (0.43) | KMT2ASMN1; SMN2CCNCCDK8L3MBTL1 | |
| SCHEMBL9871387 | 0.75 | MEN1 (0.44) | KMT2ASMN1; SMN2CDK8TACR1MEN1 | |
| SCHEMBL9871401 | 0.75 | MEN1 (0.44) | KMT2ASMN1; SMN2CDK8TACR1MEN1 | |
| SCHEMBL9871200 | 0.75 | CHEK1 (0.42) | KMT2ACDK8TACR1MEN1ALDH1A1 | |
| SCHEMBL29246429 | 0.74 | BACE1 (0.55) | KMT2AKDM4EIP6K1IP6K3IP6K2 | |
| SCHEMBL9870731 | 0.74 | CHEK1 (0.40) | KMT2ASMN1; SMN2CDK8L3MBTL1TACR1 | |
| SCHEMBL9870737 | 0.74 | CHEK1 (0.40) | KMT2ASMN1; SMN2CDK8L3MBTL1TACR1 | |
| SCHEMBL9871009 | 0.74 | AKR1C3 (0.46) | TACR1TOP2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4997837-A | Enzyme inhibitors | WARNER-LAMBERT COMPANY (US) | 1991-03-05 | — | — | US | disclosed |
| US-4906624-A | 6-(((Substituted)pyridin-3-yl)alkyl)-and alkenyl)-tetrahydro-4-hydroxypyran-2-one inhibitors of cholesterol biosynthesis | WARNER-LAMBERT COMPANY (US) | 1990-03-06 | — | — | US | disclosed |