Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NCEH1 | Q6PIU2 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17454396 | 0.83 | ALDH1A1 (0.40) | ALDH1A1RAB9ASMN1; SMN2TP53L3MBTL1 | |
| SCHEMBL17438051 | 0.81 | PTPN1 (0.42) | ALDH1A1SMN1; SMN2POLBTP53NPC1 | |
| SCHEMBL17437997 | 0.79 | MAPT (0.48) | ALDH1A1RAB9APOLBTP53L3MBTL1 | |
| SCHEMBL17452805 | 0.79 | PPARA (0.37) | ALDH1A1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL6168162 | 0.79 | RXFP1 (0.40) | ALDH1A1RAB9ASMN1; SMN2LMNATP53 | |
| SCHEMBL6170975 | 0.78 | RAB9A (0.43) | ALDH1A1RAB9ASMN1; SMN2LMNAPOLB | |
| SCHEMBL3526936 | 0.76 | ALDH1A1 (0.46) | ALDH1A1RAB9ASMN1; SMN2LMNANCEH1 | |
| SCHEMBL3635258 | 0.75 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2LMNAMAPK1MAPT | |
| SCHEMBL25171030 | 0.75 | RAB9A (0.38) | ALDH1A1RAB9ASMN1; SMN2LMNANCEH1 | |
| SCHEMBL6169856 | 0.73 | RAB9A (0.53) | ALDH1A1RAB9ASMN1; SMN2LMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1531812-A1 | FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRISTIS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-05-25 | — | — | EP | disclosed |
| WO-2004010995-A1 | FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRISTIS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-02-05 | — | — | WO | disclosed |