Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | PLAU | P00749 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | CDK4 | P11802 | 4/20 | 0.46 |
| ▸ | CCND1 | P24385 | 4/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL31257891 | 0.88 | HTR6 (0.59) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL30081896 | 0.86 | HTR6 (0.64) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL6085809 | 0.86 | HTR6 (0.59) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL31258072 | 0.86 | HTR6 (0.59) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL6086983 | 0.86 | HTR6 (0.64) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL28781648 | 0.82 | HTR6 (0.55) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL3844137 | 0.81 | HTR6 (0.70) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL31258193 | 0.81 | HTR6 (0.70) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL29459650 | 0.79 | HTR6 (0.72) | HTR6KMT2APLAUHDAC1HDAC2 | |
| SCHEMBL2247137 | 0.79 | HTR6 (0.72) | HTR6KMT2APLAUHDAC1HDAC2 |
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-104788358-A | N-(3-fluoro-4-chlorobenzyl)indole derivative and use thereof | SHANGHAI INST MATERIA MEDICA | 2015-07-22 | — | — | CN | disclosed |