Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 3/20 | 0.57 |
| ▸ | CDK9 | P50750 | 3/20 | 0.57 |
| ▸ | CDK4 | P11802 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CCNH | P51946 | 2/20 | 0.39 |
| ▸ | MNAT1 | P51948 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 4/20 | 0.37 |
| ▸ | GFER | P55789 | 2/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22437597 | 0.92 | CDK9 (0.61) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL28551273 | 0.86 | CDK7 (0.43) | CDK7CDK9CDK4KMT2ACCNH | |
| SCHEMBL31064455 | 0.82 | CDK9 (0.66) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL22449329 | 0.81 | CDK9 (0.49) | CDK7CDK9CDK4CCNHMNAT1 | |
| SCHEMBL31063968 | 0.79 | CDK9 (0.47) | CDK7CDK9CDK4CCNHMNAT1 | |
| SCHEMBL23181429 | 0.77 | CDK9 (0.47) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL20971697 | 0.76 | CDK4 (0.71) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL20971698 | 0.76 | CDK4 (0.71) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL20971691 | 0.76 | CDK4 (0.71) | CDK7CDK9CDK4KMT2ARAB9A | |
| SCHEMBL23547517 | 0.75 | CDK9 (0.45) | CDK7CDK9CDK4CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111344292-B | Compounds for inhibiting CDK7 | 伊莱利利公司 | 2022-06-03 | — | — | CN | disclosed |
| CN-111344292-A | Compounds for inhibiting CDK7 | 伊莱利利公司 | 2020-06-26 | — | — | CN | disclosed |