Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 1/20 | 0.42 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.38 |
| ▸ | WNT1 | P04628 | 1/20 | 0.37 |
| ▸ | CLK2 | P49760 | 1/20 | 0.37 |
| ▸ | CLK3 | P49761 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | PREP | P48147 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | METTL3 | Q86U44 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24369398 | 0.86 | RAB9A (0.40) | NPC1RAB9A | |
| SCHEMBL24369711 | 0.83 | CTPS1 (0.42) | HPGDSCXCR4MGAMBCAT1DPP4 | |
| SCHEMBL29488880 | 0.83 | CTPS1 (0.42) | HPGDSCXCR4MGAMBCAT1DPP4 | |
| SCHEMBL24369605 | 0.82 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24369413 | 0.79 | SMYD3 (0.39) | WNT1CLK2CLK3GSK3BDYRK1A | |
| SCHEMBL24369392 | 0.79 | SMYD3 (0.44) | WNT1CLK2CLK3DYRK1A | |
| SCHEMBL24369608 | 0.73 | CHRNA7 (0.41) | GSK3BNPC1RAB9ACHRNA7 | |
| SCHEMBL24369162 | 0.72 | CTPS1 (0.45) | BCAT1 | |
| SCHEMBL29488826 | 0.72 | CTPS1 (0.45) | BCAT1 | |
| SCHEMBL24369378 | 0.69 | CTPS1 (0.44) | 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 |
|---|---|---|---|---|---|---|---|
| WO-2022087634-A1 | CTPS1 INHIBITORS AND USES THEREOF | NIMBUS CLOTHO, INC. (US) | 2022-04-28 | — | — | WO | disclosed |