Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 9/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | IKBKB | O14920 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GFER | P55789 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL702743 | 0.86 | CHEK1 (0.41) | CHEK1ALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL560857 | 0.85 | CHEK1 (0.48) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL560856 | 0.85 | CHEK1 (0.48) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL693888 | 0.85 | CHEK1 (0.48) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL561298 | 0.77 | CHEK1 (0.47) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL560379 | 0.77 | CHEK1 (0.47) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL560380 | 0.77 | CHEK1 (0.47) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL708749 | 0.77 | ALDH1A1 (0.43) | CHEK1ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL2280598 | 0.74 | CHEK1 (0.56) | CHEK1MEN1KMT2AIKBKB | |
| SCHEMBL2280599 | 0.74 | CHEK1 (0.56) | CHEK1MEN1KMT2AIKBKB |
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-2421844-A1 | THIOPHENE INHIBITORS OF IKK-B SERINE-THREONINE PROTEIN KINASE | Chroma Therapeutics Ltd. (GB) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010122294-A1 | THIOPHENE INHIBITORS OF IKK-B SERINE-THREONINE PROTEIN KINASE | CHROMA THERAPEUTICS LTD (GB) | 2010-10-28 | — | — | WO | disclosed |