Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | CHKA | P35790 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.39 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19027125 | 0.78 | HRH4 (0.54) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL24615261 | 0.76 | HRH4 (0.47) | HRH4PKMALOX15CASP1HSD17B10 | |
| SCHEMBL12654054 | 0.76 | HRH4 (0.51) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL31415288 | 0.76 | GRIN2D (0.57) | HRH4TSHRSMN1; SMN2HSD17B10CNR2 | |
| SCHEMBL30476654 | 0.76 | HRH4 (0.51) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL465754 | 0.76 | GRIN2D (0.57) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL789776 | 0.76 | HRH4 (0.51) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL17787658 | 0.76 | HRH4 (0.51) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL22045136 | 0.76 | HRH4 (0.51) | HRH4NPC1TSHRRECQLRAB9A | |
| SCHEMBL4554066 | 0.76 | GRIN2D (0.57) | HRH4TSHRSMN1; SMN2HSD17B10CNR2 |
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-110809577-A | Modulators of adenosine A2A receptor | 雷沃医疗有限公司 | 2020-02-18 | — | — | CN | disclosed |