Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 14/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.51 |
| ▸ | HPGD | P15428 | 10/20 | 0.51 |
| ▸ | MAPT | P10636 | 8/20 | 0.50 |
| ▸ | HTT | P42858 | 7/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL231419 | 0.83 | KDM4E (0.64) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL4017475 | 0.82 | ALDH1A1 (0.62) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL230641 | 0.78 | ALDH1A1 (0.70) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL18932081 | 0.77 | RECQL (0.58) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL16692204 | 0.77 | KDM4E (0.69) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL11522697 | 0.77 | ALDH1A1 (0.69) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL17405258 | 0.76 | ALDH1A1 (0.38) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL25112954 | 0.73 | KDM4E (0.49) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL5009162 | 0.72 | KDM4E (0.77) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL12854051 | 0.72 | RECQL (0.56) | KDM4EALDH1A1HPGDMAPTHTT |
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-104513997-A | 1-ethyl-2-substituted benzimidazole carbon steel pickling corrosion inhibitor and application thereof | NANJING UNIVERSITY OF TECHNOLOGY | 2015-04-15 | — | — | CN | disclosed |