Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 7/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.32 |
| ▸ | PLK4 | O00444 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | PRKACA | P17612 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | LTK | P29376 | 1/20 | 0.32 |
| ▸ | GRK5 | P34947 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 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 | |
|---|---|---|---|---|
| SCHEMBL584790 | 0.87 | HSD17B1 (0.37) | HSD17B1HSD17B2MAP4K4SRCCYP3A4 | |
| SCHEMBL28299925 | 0.83 | QPCT (0.35) | ESR2 | |
| SCHEMBL28564877 | 0.80 | ALDH1A1 (0.35) | ADORA1 | |
| SCHEMBL27787590 | 0.79 | KIT (0.31) | KDRFLT3 | |
| SCHEMBL28042627 | 0.79 | ALOX5 (0.36) | HSD17B1HSD17B2ESR2 | |
| SCHEMBL7257246 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL5050049 | 0.78 | — | — | |
| SCHEMBL28384769 | 0.78 | MMP3 (0.36) | ADORA1ESR1ESR2 | |
| SCHEMBL1640993 | 0.77 | HSD17B1 (0.31) | ADORA1HSD17B1HSD17B2 | |
| SCHEMBL6803316 | 0.76 | — | — |
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-101921278-A | Tri-thiol porphyrin with 6-carbon atom main chain | UNIV NORTHWEST NORMAL | 2010-12-22 | — | — | CN | disclosed |