Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6829312 | 0.84 | TDP1 (0.44) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6826476 | 0.81 | KMT2A (0.63) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6831027 | 0.80 | LMNA (0.51) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6826069 | 0.75 | KMT2A (0.47) | ALDH1A1SMN1; SMN2KMT2AMAPTHTT | |
| SCHEMBL6828867 | 0.74 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6829197 | 0.73 | POLB (0.55) | ALDH1A1KMT2AMAPTLMNATSHR | |
| SCHEMBL2324097 | 0.73 | HTT (0.55) | ALDH1A1KMT2AMAPTLMNAHTT | |
| SCHEMBL6829499 | 0.73 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6921975 | 0.72 | RAB9A (0.38) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA | |
| SCHEMBL6829169 | 0.72 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2KMT2AMAPTLMNA |
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-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |