Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 3/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30896807 | 0.80 | HTR2A (0.42) | SRCAURKAKDM4ECHEK1DAPK3 | |
| SCHEMBL14966684 | 0.80 | GLS (0.45) | PTGS2ALDH1A1KMT2APOLB | |
| SCHEMBL22101196 | 0.75 | PTGS2 (0.39) | PTGS2TDP1CNR1NPC1RAB9A | |
| SCHEMBL22101239 | 0.75 | NPC1 (0.43) | PTGS2TDP1CNR1NPC1RAB9A | |
| SCHEMBL5863967 | 0.75 | TDP1 (0.56) | TDP1CNR1PKMAURKAALDH1A1 | |
| SCHEMBL14965798 | 0.75 | BRD4 (0.43) | PTGS2TDP1NPC1RAB9AMITF | |
| SCHEMBL22393580 | 0.73 | BTK (0.39) | PTGS2TDP1CNR1AURKASYK | |
| SCHEMBL22101777 | 0.73 | TDP1 (0.40) | PTGS2TDP1CNR1NPC1RAB9A | |
| SCHEMBL14966308 | 0.73 | MAPT (0.44) | PKMKMT2APOLB | |
| SCHEMBL14966121 | 0.72 | BRD4 (0.46) | PTGS2RAB9APKMALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013072825-A1 | PHTALAZINONE DERIVATIVES AS MPEGS -1 INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2013-05-23 | — | — | WO | disclosed |