Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | CDK2 | P24941 | 3/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 7/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29263665 | 0.88 | NR4A2 (0.59) | MAPTCDK2NR4A2NPC1F2 | |
| SCHEMBL6488744 | 0.83 | MAPT (0.49) | MAPTCDK2NPC1MCL1 | |
| SCHEMBL5327849 | 0.83 | CDK2 (0.56) | MAPTCDK2 | |
| SCHEMBL28265651 | 0.80 | NR4A2 (0.51) | MAPTNR4A2 | |
| SCHEMBL7508094 | 0.80 | CDK2 (0.46) | MAPTCDK2NPC1MCL1 | |
| SCHEMBL27709706 | 0.80 | CDK2 (0.46) | MAPTCDK2NPC1MCL1 | |
| SCHEMBL22188908 | 0.78 | ALDH1A1 (0.56) | MAPTCDK2 | |
| SCHEMBL22188914 | 0.78 | POLB (0.62) | MAPTCDK2NR4A2NPC1MCL1 | |
| SCHEMBL3352674 | 0.78 | CDK2 (0.44) | MAPTCDK2NPC1MCL1 | |
| SCHEMBL10746517 | 0.77 | CDK2 (0.53) | MAPTCDK2 |
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-109153643-A | Substituted indole MCL-1 inhibitors | 范德比尔特大学 | 2019-01-04 | — | — | CN | disclosed |