Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28651448 | 0.86 | SMN1; SMN2 (0.39) | SMN1; SMN2KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL28926290 | 0.84 | CDK9 (0.43) | CDK9SMN1; SMN2KDM4EGAACYP2C9 | |
| SCHEMBL28638729 | 0.83 | CDK9 (0.42) | CDK9SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL28646718 | 0.82 | CDK9 (0.41) | CDK9SMN1; SMN2KDM4EMAPTMEN1 | |
| SCHEMBL28645790 | 0.81 | CDK9 (0.44) | CDK9SMN1; SMN2KDM4EKMT2AGAA | |
| SCHEMBL28639222 | 0.81 | CDK9 (0.40) | CDK9SMN1; SMN2KDM4EMAPTMEN1 | |
| SCHEMBL19874000 | 0.80 | ALDH1A1 (0.34) | CDK9TNFALDH1A1 | |
| SCHEMBL28644072 | 0.80 | CDK9 (0.40) | CDK9SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL28651571 | 0.79 | CDK9 (0.39) | CDK9SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL28660748 | 0.78 | SMN1; SMN2 (0.51) | CDK9SMN1; SMN2KDM4EMAPTMEN1 |
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-107428744-B | Novel heterocyclic compounds and their use in medicine and cosmetics | 盖尔德马研究及发展公司 | 2021-09-24 | — | — | CN | disclosed |