Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL570637 | 0.85 | LTA4H (0.44) | LTA4HNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10285531 | 0.77 | LTA4H (0.44) | LTA4HNPC1SMN1; SMN2RAB9ATP53 | |
| SCHEMBL16704935 | 0.76 | PDE10A (0.44) | NPC1RAB9AKDM4EALDH1A1DRD1 | |
| SCHEMBL15064845 | 0.75 | PDE10A (0.37) | LTA4HNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL12473781 | 0.74 | LTA4H (0.47) | LTA4HNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL10285475 | 0.74 | PDE10A (0.37) | LTA4HKDM4EMAPK1DRD1PDE10A | |
| SCHEMBL2168662 | 0.72 | LTA4H (0.54) | LTA4HNPC1SMN1; SMN2RAB9AKDM4E | |
| SCHEMBL9981213 | 0.69 | LTA4H (0.43) | LTA4HNPC1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL570451 | 0.69 | LTA4H (0.50) | LTA4HPDE10AACHE | |
| SCHEMBL29795482 | 0.69 | LTA4H (0.56) | LTA4HNPC1SMN1; SMN2RAB9AKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2687529-B1 | CONDENSED HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL (JP) | 2016-07-13 | — | — | EP | disclosed |
| US-9029388-B2 | Condensed heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-05-12 | — | — | US | disclosed |
| US-9029388-B2 | Condensed heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2015-05-12 | — | — | US | disclosed |
| EP-2687529-A1 | CONDENSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2014-01-22 | — | — | EP | disclosed |