Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 2/20 | 0.51 |
| ▸ | JAK2 | O60674 | 2/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.51 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.43 |
| ▸ | AXL | P30530 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | FER | P16591 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | MARK3 | P27448 | 1/20 | 0.40 |
| ▸ | FLT4 | P35916 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11756961 | 0.88 | PDPK1 (0.51) | PDPK1JAK2DYRK1AGSK3BLMNA | |
| SCHEMBL14564411 | 0.81 | MAPT (0.49) | GSK3BLMNAABL1BCRKDM4E | |
| SCHEMBL14979221 | 0.81 | MAP2K4 (0.54) | GSK3BLMNAABL1BCR | |
| SCHEMBL6612568 | 0.81 | GSK3B (0.56) | GSK3BLMNAGPR17KDM4E | |
| SCHEMBL27983814 | 0.77 | PDPK1 (0.58) | PDPK1JAK2DYRK1AGSK3BIDO1 | |
| SCHEMBL462088 | 0.77 | LMNA (0.68) | PDPK1LMNAIDO1CDK2FLT3 | |
| SCHEMBL11388 | 0.77 | PDPK1 (0.58) | PDPK1JAK2DYRK1AGSK3BIDO1 | |
| SCHEMBL28661400 | 0.77 | PDPK1 (0.58) | PDPK1JAK2DYRK1AGSK3BIDO1 | |
| SCHEMBL29651055 | 0.77 | LMNA (0.68) | PDPK1LMNAIDO1CDK2FLT3 | |
| SCHEMBL17113571 | 0.77 | PDPK1 (0.62) | PDPK1JAK2DYRK1AGSK3BIDO1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103476768-B | 6, 5-heterocyclic propargyl alcohol compounds and uses thereof | HOFFMANN LA ROCHE | 2015-07-08 | — | — | CN | disclosed |
| CN-101743232-B | Compounds and methods for modulating fxr | LILLY CO ELI | 2013-03-06 | — | — | CN | disclosed |
| CN-101448791-B | Fxr agonists | LILLY CO ELI | 2011-11-16 | — | — | CN | disclosed |
| CN-101743232-A | Regulate the Compounds and methods for of FXR | LILLY CO ELI | 2010-06-16 | — | — | CN | disclosed |
| CN-101448791-A | FXR agonists | LILLY CO ELI (US) | 2009-06-03 | — | — | CN | disclosed |
| CN-101448798-A | Compounds and methods for modulating FXR | LILLY CO ELI (US) | 2009-06-03 | — | — | CN | disclosed |