Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CBX7 | O95931 | 1/20 | 0.34 |
| ▸ | CDY1; CDY1B | Q9Y6F8 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2230498 | 0.79 | HTR1A (0.36) | NOTUMHDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL2231425 | 0.79 | HTR1A (0.36) | NOTUMHDAC1HDAC2HDAC6ALDH1A1 | |
| SCHEMBL9679997 | 0.77 | BACE1 (0.40) | MAP2K1BACE1HTR2AHTR2CHTR2B | |
| SCHEMBL9681666 | 0.72 | GABRA1 (0.39) | TSHRALDH1A1 | |
| SCHEMBL10559978 | 0.71 | NOTUM (0.44) | NOTUMPDK2MAP2K1L3MBTL1 | |
| SCHEMBL15135472 | 0.70 | RARB (0.36) | NOTUMPDK2HDAC3HDAC4HDAC1 | |
| SCHEMBL6748962 | 0.69 | NOTUM (0.45) | NOTUMTSHRHTTHDAC3HDAC4 | |
| SCHEMBL6770006 | 0.68 | HDAC1 (0.56) | HTTHDAC3HDAC4HDAC1HDAC2 | |
| SCHEMBL30991208 | 0.64 | PDK2 (0.41) | NOTUMPDK2HDAC4KDM4EALDH1A1 | |
| SCHEMBL29392112 | 0.64 | ALDH1A1 (0.40) | NOTUMPDK2KDM4EL3MBTL1ALDH1A1 |
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-0504695-A1 | New carboxamides, their preparation and pharmaceutical compositions containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1992-09-23 | — | — | EP | disclosed |