Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GPR3 | P46089 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28191212 | 0.80 | GPR3 (0.47) | NTRK1KDM4EALDH1A1GPR3HTT | |
| SCHEMBL9177751 | 0.77 | EGFR (0.51) | NTRK1KDM4EALDH1A1L3MBTL1KMT2A | |
| SCHEMBL28186733 | 0.73 | ALDH1A1 (0.57) | ALDH1A1GPR3L3MBTL1KMT2AMEN1 | |
| SCHEMBL28853473 | 0.72 | NTRK1 (0.39) | NTRK1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14047742 | 0.70 | L3MBTL1 (0.57) | NTRK1KDM4EALDH1A1GPR3L3MBTL1 | |
| SCHEMBL30648519 | 0.70 | CYP11B2 (0.47) | KDM4EALDH1A1KMT2AMEN1HTT | |
| SCHEMBL13890161 | 0.69 | KDM4E (0.58) | KDM4EALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL8476766 | 0.69 | KDM4E (0.44) | NTRK1KDM4EALDH1A1KMT2AMEN1 | |
| SCHEMBL28362345 | 0.68 | APP (0.48) | KDM4EALDH1A1L3MBTL1KMT2AMEN1 | |
| SCHEMBL5026697 | 0.68 | ALKBH5 (0.59) | KDM4EALDH1A1GPR3L3MBTL1KMT2A |
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-107445991-A | A kind of Phosphine ligands of indoles skeleton and its preparation method and application | 香港理工大学深圳研究院 | 2017-12-08 | — | — | CN | disclosed |