Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G1B | P04054 | 1/20 | 0.65 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.65 |
| ▸ | CA9 | Q16790 | 3/20 | 0.65 |
| ▸ | CA1 | P00915 | 2/20 | 0.65 |
| ▸ | CA2 | P00918 | 2/20 | 0.65 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.65 |
| ▸ | CA12 | O43570 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | CA4 | P22748 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | PPARA | Q07869 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | IDO1 | P14902 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL7904992 | 0.95 | PLA2G1B (0.60) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL7898829 | 0.94 | PLA2G1B (0.59) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL7898827 | 0.91 | NR1H3 (0.60) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL18053290 | 0.87 | CA1 (0.76) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL25314971 | 0.85 | HPGD (0.56) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL8586537 | 0.85 | CA9 (0.55) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL8915839 | 0.85 | CA9 (0.67) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL1618305 | 0.84 | ALDH1A1 (0.70) | CA9CA1CA2SCN2ACA12 | |
| SCHEMBL13479534 | 0.84 | ADORA2A (0.63) | PLA2G1BATG4BCA9CA1CA2 | |
| SCHEMBL28462498 | 0.83 | ALDH1A1 (0.59) | PLA2G1BATG4BCA9CA1CA2 |
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-1319090-A | Novel substuted indolimones, their preparation process and use as medicine | BOEHRINGER INGELHEIM PHARMA (DE) | 2001-10-24 | — | — | CN | disclosed |