Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27808951 | 0.78 | NPSR1 (0.45) | HDAC1HDAC6LMNATSHRALDH1A1 | |
| SCHEMBL3100495 | 0.78 | ALDH1A1 (0.47) | HDAC1HDAC6LMNAALDH1A1MAPK1 | |
| SCHEMBL27809162 | 0.77 | SCD (0.43) | LMNAPOLBKDM4ETSHRALDH1A1 | |
| SCHEMBL3088141 | 0.75 | ALDH1A1 (0.51) | HDAC1HDAC6LMNATSHRALDH1A1 | |
| SCHEMBL5592736 | 0.71 | ALDH1A1 (0.49) | GHSRHDAC1HDAC6LMNAPOLB | |
| SCHEMBL27787111 | 0.70 | ALDH1A1 (0.41) | SMN1; SMN2LMNAKDM4ETSHRALDH1A1 | |
| SCHEMBL5908646 | 0.70 | USP2 (0.52) | SMN1; SMN2LMNAPOLBKDM4ETSHR | |
| SCHEMBL27809032 | 0.69 | CYP19A1 (0.41) | GHSRSMN1; SMN2LMNAPOLBKDM4E | |
| SCHEMBL27787150 | 0.69 | ALDH1A1 (0.43) | GHSRSMN1; SMN2CYP1A2LMNATSHR | |
| SCHEMBL27787130 | 0.68 | SCD (0.41) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101784520-A | Novel malonic acid sulfonamide derivative and pharmaceutical use thereof | MITSUBISHI TANABE PHARMA CORP | 2010-07-21 | — | — | CN | disclosed |