Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.32 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.32 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31124321 | 0.86 | ATR (0.41) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL18106503 | 0.81 | CA12 (0.42) | CA1CA12CA9CYP17A1SYK | |
| SCHEMBL25829865 | 0.80 | ATR (0.41) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL29955382 | 0.80 | CYP17A1 (0.42) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL25863102 | 0.78 | ATR (0.36) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL26429672 | 0.78 | ATR (0.41) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL28895299 | 0.76 | CA12 (0.44) | CA1CA12CA9CYP17A1SYK | |
| SCHEMBL3126895 | 0.75 | ATR (0.43) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL30937750 | 0.75 | HSP90AA1 (0.40) | ATRCA1CA12CA9CYP17A1 | |
| SCHEMBL25829765 | 0.75 | ATR (0.37) | ATRCA1CA12CA9CYP17A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023137007-A1 | PROCESSES FOR THE PREPARATION OF 4,6,7-TRIFLUORO-1H-INDOLE-2-CARBOXYLIC ACID | ENANTA PHARMACEUTICALS, INC. (US) | 2023-07-20 | — | — | WO | disclosed |