Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KRAS | P01116 | 1/20 | 0.32 |
| ▸ | GCK | P35557 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3167765 | 0.82 | ICAM1 (0.41) | ICAM1SELEVCAM1TNKS2TNKS | |
| SCHEMBL3270312 | 0.82 | TNKS2 (0.39) | TNKS2TNKSPARP1PARP15PARP2 | |
| SCHEMBL3268887 | 0.82 | PTGS1 (0.35) | ICAM1SELEVCAM1PTGS1PTGS2 | |
| SCHEMBL3835657 | 0.81 | ALDH1A1 (0.43) | ICAM1SELEVCAM1PARP1PTGS1 | |
| SCHEMBL3268792 | 0.80 | CDC7 (0.36) | TNKS2TNKSPARP1PARP15PARP2 | |
| SCHEMBL3268877 | 0.79 | PARP15 (0.35) | TNKS2TNKSPARP1PARP15ALDH1A1 | |
| SCHEMBL4039379 | 0.78 | CHUK (0.42) | ICAM1SELEVCAM1PARP1PTGS1 | |
| SCHEMBL3274125 | 0.77 | ICAM1 (0.34) | ICAM1SELEVCAM1PTGS1PTGS2 | |
| SCHEMBL3270015 | 0.76 | TUBB4A (0.42) | TNKS2TNKSPARP1PARP15PARP2 | |
| SCHEMBL4033284 | 0.75 | PTGS1 (0.37) | ICAM1SELEVCAM1PARP1PTGS1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1784409-B1 | SUBSTITUTED THIENOPYRROLE CARBOXYLIC ACID AMIDES, PYRROLOTHIAZOLE CARBOXYLIC ACID AMIDES, AND RELATED ANALOGS AS INHIBITORS OF CASEIN KINASE I EPSILON | AVENTIS PHARMA INC (US) | 2010-06-16 | — | — | EP | claimed |