Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 2/20 | 0.53 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.53 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.53 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.53 |
| ▸ | ITGAV | P06756 | 1/20 | 0.53 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.53 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.53 |
| ▸ | ITGAL | P20701 | 1/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.42 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.42 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.42 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.42 |
| ▸ | SLC6A11 | P48066 | 2/20 | 0.42 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.42 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3678052 | 1.00 | ITGB1 (0.53) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL16045376 | 1.00 | ITGB1 (0.53) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL17966413 | 0.85 | ITGB1 (0.37) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL17966411 | 0.85 | ITGB1 (0.37) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL19628798 | 0.82 | IRAK4 (0.35) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL25255171 | 0.81 | HTT (0.38) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL25254019 | 0.81 | HTT (0.38) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL25291800 | 0.81 | HTT (0.38) | ITGB1ITGA5ITGB3ITGB2ITGAV | |
| SCHEMBL5671846 | 0.77 | KMT2A (0.34) | IRAK4GAACACNA1CSCN5AKCNH2 | |
| SCHEMBL2155526 | 0.77 | KMT2A (0.34) | IRAK4GAACACNA1CSCN5AKCNH2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105229012-A | Be used for the treatment of the Compounds and methods for of bacteriological infection | ASTRAZENECA AB | 2016-01-06 | — | — | CN | disclosed |
| CN-1222519-C | Reverse hydroxamate inhibitors of matrix metalloproteinases | ABBOTT LAB (US) | 2005-10-12 | — | — | CN | disclosed |
| EP-1019400-B1 | BENZO(5,6)CYCLOHEPTAPYRIDINE COMPOUNDS USEFUL AS FARNESYL PROTEIN TRANSFERASE INHIBITORS | SCHERING CORP (US) | 2004-08-11 | — | — | EP | disclosed |
| CN-1339032-A | Reverse hydroxamate inhibitors of matrix metalloproteinases | ABBOTT LAB (US) | 2002-03-06 | — | — | CN | disclosed |
| EP-1019400-A1 | BENZO(5,6)CYCLOHEPTAPYRIDINE COMPOUNDS USEFUL AS FARNESYL PROTEIN TRANSFERASE INHIBITORS | SCHERING CORPORATION (US) | 2000-07-19 | — | — | EP | disclosed |
| US-5939416-A | INHIBIT RAS FUNCTION, USE FOR TREATING TUMOR CELLS EXPRESSING AN ACTIVATED RAS ONCOGENE IN MAMMALS | SCHERING CORPORATION (US) | 1999-08-17 | — | — | US | disclosed |
| WO-1998057970-A1 | BENZO(5,6)CYCLOHEPTAPYRIDINE COMPOUNDS USEFUL AS FARNESYL PROTEIN TRANSFERASE INHIBITORS | SCHERING CORPORATION (US) | 1998-12-23 | — | — | WO | disclosed |