Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.46 |
| ▸ | CCND1 | P24385 | 4/20 | 0.46 |
| ▸ | HTR6 | P50406 | 5/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL29073296 | 0.85 | CDK4 (0.49) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073167 | 0.85 | CDK4 (0.55) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073124 | 0.83 | NPC1 (0.50) | CDK4CCND1HTR2AHTR2CMAPK1 | |
| SCHEMBL29073193 | 0.82 | CDK4 (0.49) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073206 | 0.82 | CDK4 (0.49) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073303 | 0.82 | CDK4 (0.49) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073134 | 0.82 | CDK4 (0.45) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073181 | 0.80 | MAPK1 (0.52) | CDK4CCND1HDAC1HDAC2HDAC10 | |
| SCHEMBL29073180 | 0.79 | CDK4 (0.49) | CDK4CCND1HTR6HTR2AHTR2C | |
| SCHEMBL29073304 | 0.79 | CDK4 (0.45) | CDK4CCND1HTR6HTR2AHTR2C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115043846-B | Preparation method of 2-oxo alkyl-9H-pyrrolo [1,2-a ] indol-9-one compound | 西北师范大学 | 2023-09-15 | — | — | CN | claimed |
| CN-115043846-A | Preparation method of 2-oxoalkyl-9H-pyrrolo [1,2-a ] indole-9-ketone compound | 西北师范大学 | 2022-09-13 | — | — | CN | claimed |
| CN-115043846-B | Preparation method of 2-oxo alkyl-9H-pyrrolo [1,2-a ] indol-9-one compound | 西北师范大学 | 2023-09-15 | — | — | CN | disclosed |
| CN-115043846-A | Preparation method of 2-oxoalkyl-9H-pyrrolo [1,2-a ] indole-9-ketone compound | 西北师范大学 | 2022-09-13 | — | — | CN | disclosed |