Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 8/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1587098 | 0.83 | NOTUM (0.42) | NOTUMKDM4EKEAP1SMN1; SMN2HIF1A | |
| SCHEMBL30633068 | 0.83 | NOTUM (0.42) | NOTUMKDM4EKEAP1SMN1; SMN2HIF1A | |
| SCHEMBL1587097 | 0.83 | NOTUM (0.39) | NOTUMKDM4EKEAP1SMN1; SMN2HIF1A | |
| SCHEMBL18284703 | 0.81 | NOTUM (0.38) | NOTUMKDM4EKEAP1SMN1; SMN2HIF1A | |
| SCHEMBL4531873 | 0.81 | HCRTR1 (0.38) | NOTUMKDM4EKEAP1HCRTR1HCRTR2 | |
| SCHEMBL2170102 | 0.79 | NPC1 (0.46) | NOTUMNISCHKDM4ESMN1; SMN2HIF1A | |
| SCHEMBL18378736 | 0.78 | NOTUM (0.47) | NOTUMKEAP1SMN1; SMN2TSHRCYP1A2 | |
| SCHEMBL1586174 | 0.78 | TSHR (0.43) | NOTUMNISCHKDM4EKEAP1HCRTR1 | |
| SCHEMBL22702085 | 0.76 | NOTUM (0.47) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL7111602 | 0.76 | NOTUM (0.44) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021137665-A1 | 1, 2, 3-TRIAZOLE DERIVATIVE COMPOUND AS HSP90 INHIBITOR, AND USE THEREOF | 이화여자대학교 산학협력단 | 2021-07-08 | — | — | WO | disclosed |
| EP-3538088-A1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS | 3-V Biosciences, Inc. (US) | 2019-09-18 | — | — | EP | disclosed |
| US-9981942-B2 | Piperidine derivatives having multimodal activity against pain | LABORATORIOS DEL DR. ESTEVE S.A. (ES) | 2018-05-29 | — | — | US | disclosed |
| WO-2018089904-A1 | HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS | 3-V BIOSCIENCES, INC. (US) | 2018-05-17 | — | — | WO | disclosed |