Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6921975 | 0.86 | RAB9A (0.38) | KDM4EL3MBTL1NPSR1ALDH1A1LMNA | |
| SCHEMBL6829309 | 0.81 | KMT2A (0.49) | KDM4EL3MBTL1TSHRTDP1ALDH1A1 | |
| SCHEMBL6828819 | 0.77 | PRSS1 (0.40) | KDM4EL3MBTL1TSHRTDP1ALDH1A1 | |
| SCHEMBL6829499 | 0.76 | ALDH1A1 (0.41) | KDM4EL3MBTL1TSHRTDP1ALDH1A1 | |
| SCHEMBL6826069 | 0.75 | KMT2A (0.47) | KDM4EL3MBTL1TDP1ALDH1A1PRSS1 | |
| SCHEMBL1680516 | 0.75 | ALDH1A1 (0.46) | KDM4EALDH1A1LMNAPOLBHTT | |
| SCHEMBL6829312 | 0.75 | TDP1 (0.44) | KDM4EL3MBTL1TSHRNPSR1TDP1 | |
| SCHEMBL6828837 | 0.74 | ALDH1A1 (0.40) | KDM4EL3MBTL1TSHRTDP1ALDH1A1 | |
| SCHEMBL6829169 | 0.72 | ALDH1A1 (0.49) | KDM4EL3MBTL1TSHRTDP1ALDH1A1 | |
| SCHEMBL6829604 | 0.72 | PRSS1 (0.48) | KDM4ETSHRNPSR1TDP1ALDH1A1 |
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 |