Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MYC | P01106 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | FABP3 | P05413 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27458636 | 0.82 | TTR (0.59) | TTRKMT2AKDM4EMEN1ALDH1A1 | |
| SCHEMBL27557477 | 0.81 | RXFP1 (0.50) | TTRNPC1KDM4EMYCMAPT | |
| SCHEMBL27796625 | 0.80 | TTR (0.46) | TTRKMT2AKDM4EMEN1MAPT | |
| SCHEMBL27631357 | 0.80 | DHODH (0.58) | TTRDHODHNR4A1 | |
| SCHEMBL28151298 | 0.78 | SORT1 (0.43) | NPC1RAB9AKMT2AAURKASORT1 | |
| SCHEMBL28201920 | 0.78 | AKR1C2 (0.48) | NPC1RAB9AKMT2AAURKASORT1 | |
| SCHEMBL27501023 | 0.78 | GPR35 (0.56) | KMT2AKDM4EALDH1A1AKR1C2AKR1C3 | |
| SCHEMBL27501021 | 0.76 | PLAU (0.49) | TTRTSHR | |
| SCHEMBL17209586 | 0.74 | ALDH1A1 (0.52) | NPC1RAB9AKMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL28565906 | 0.74 | KMT2A (0.53) | NPC1RAB9AKMT2AAURKASORT1 |
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-104854108-A | Pyrrolotriazinone derivatives as pi3k inhibitors | ALMIRALL SA | 2015-08-19 | — | — | CN | disclosed |