Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FNTA | P49354 | 3/20 | 0.48 |
| ▸ | FNTB | P49356 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12879187 | 0.91 | NPC1 (0.53) | FNTAFNTBNPC1RAB9ACA12 | |
| SCHEMBL5863201 | 0.83 | TP53 (0.57) | — | |
| SCHEMBL5692582 | 0.83 | NPC1 (0.61) | FNTAFNTBNPC1RAB9ACA12 | |
| SCHEMBL2832878 | 0.77 | NPC1 (0.54) | FNTAFNTBNPC1RAB9ACA12 | |
| SCHEMBL30285148 | 0.77 | CA12 (0.59) | DHODHCA12CA1CA2CA9 | |
| SCHEMBL7719381 | 0.77 | CA12 (0.59) | DHODHCA12CA1CA2CA9 | |
| SCHEMBL29617015 | 0.76 | TP53 (0.62) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL8359572 | 0.76 | NPC1 (0.53) | FNTAFNTBNPC1CA12CA1 | |
| SCHEMBL28832198 | 0.75 | DHODH (0.49) | DHODHCA12CA1CA2CA9 | |
| SCHEMBL15907645 | 0.75 | CNR2 (0.55) | NPC1RAB9A |
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-104507912-A | (aza-)isoquinolinone derivatives | MERCK PATENT GMBH | 2015-04-08 | — | — | CN | disclosed |