Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 1/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CMA1 | P23946 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL6530144 | 0.82 | CDK5 (0.51) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E | |
| SCHEMBL27744436 | 0.82 | CDK5 (0.51) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E | |
| SCHEMBL6528479 | 0.82 | LPO (0.51) | CYP19A1ALDH1A1KDM4EMAPTCMA1 | |
| SCHEMBL7510401 | 0.81 | CDK5 (0.50) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E | |
| SCHEMBL2979842 | 0.81 | CDK5 (0.50) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E | |
| SCHEMBL15707234 | 0.81 | CDK5 (0.50) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E | |
| SCHEMBL6531582 | 0.80 | CYP11B1 (0.49) | CYP19A1ALDH1A1KDM4EKDM4CKDM5B | |
| SCHEMBL5761329 | 0.79 | CYP11B1 (0.54) | CDK5CDK5R1ALDH1A1MAPTHSP90AA1 | |
| SCHEMBL1196868 | 0.78 | HPGDS (0.51) | CDK5CDK5R1CYP19A1MAPTKDM4C | |
| SCHEMBL17982242 | 0.77 | CDK5 (0.53) | CDK5CDK5R1CYP19A1ALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |