Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | DHFR | P00374 | 3/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9566496 | 0.84 | RAB9A (0.61) | HRH4RAB9ADHFRMAP4K4ADORA2A | |
| SCHEMBL7608701 | 0.80 | SMN1; SMN2 (0.69) | SMN1; SMN2TSHRNPSR1RECQLHRH4 | |
| SCHEMBL6584030 | 0.79 | HRH4 (0.56) | HRH4RAB9ADHFRMAP4K4ADORA2A | |
| SCHEMBL8125008 | 0.78 | SMN1; SMN2 (0.65) | SMN1; SMN2TSHRNPSR1RECQLHRH4 | |
| SCHEMBL8413392 | 0.77 | HTR2B (0.73) | SMN1; SMN2TSHRNPSR1RECQLRAB9A | |
| SCHEMBL29291623 | 0.77 | STK4 (0.45) | SMN1; SMN2TSHRRAB9AMAP4K4 | |
| SCHEMBL15100699 | 0.76 | RECQL (0.47) | SMN1; SMN2TSHRNPSR1RECQLRAB9A | |
| SCHEMBL10589866 | 0.74 | IDO1 (0.57) | SMN1; SMN2TSHRHRH4RAB9ADHFR | |
| SCHEMBL11193275 | 0.74 | MEN1 (0.43) | HRH4ADORA2AADORA2BADORA1 | |
| SCHEMBL10344628 | 0.73 | BACE1 (0.53) | HRH4DHFRMAP4K4ADORA2AADORA2B |
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-105837525-A | 2, 4-diamine-1, 3, 5-triazine compound and preparation method and application thereof | 浙江工业大学 | 2016-08-10 | — | — | CN | disclosed |