Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5821742 | 1.00 | CA1 (0.41) | CA1CA2ALDH3A1ALDH1A1TSHR | |
| SCHEMBL5819897 | 0.87 | CA1 (0.55) | CA1CA2ALDH3A1ALDH1A1TSHR | |
| SCHEMBL5819895 | 0.87 | CA1 (0.55) | CA1CA2ALDH3A1ALDH1A1TSHR | |
| SCHEMBL5820102 | 0.82 | ALDH3A1 (0.58) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5820103 | 0.82 | ALDH3A1 (0.58) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5822089 | 0.80 | CA1 (0.34) | CA1CA2ALDH3A1ALDH1A1 | |
| SCHEMBL5816191 | 0.80 | SIRT1 (0.43) | CA1CA2ALDH3A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL5821735 | 0.78 | CA1 (0.45) | CA1CA2ALDH3A1ALDH1A1TSHR | |
| SCHEMBL4575487 | 0.70 | KDR (0.63) | CA1CA2ALDH3A1ALDH1A1TSHR | |
| SCHEMBL4575494 | 0.70 | KDR (0.63) | CA1CA2ALDH3A1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006105795-A1 | NOVEL INDOLINONE DERIVATIVES | LEO PHARMA A/S (DK) | 2006-10-12 | — | — | WO | disclosed |