Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | HBB | P68871 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17919704 | 0.81 | CYP2A6 (0.52) | KDM4ENPC1RAB9ACASP3SENP7 | |
| SCHEMBL31444692 | 0.80 | PDE2A (0.47) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL19414340 | 0.78 | NPC1 (0.41) | ALDH1A1KDM4EHSD17B10HBBMEN1 | |
| SCHEMBL2671991 | 0.78 | THRB (0.44) | ALDH1A1KDM4EMEN1KMT2ANPC1 | |
| SCHEMBL16705379 | 0.78 | NPC1 (0.41) | KDM4ENPC1RAB9ACASP3SENP7 | |
| SCHEMBL23980728 | 0.76 | NPC1 (0.40) | KDM4ENPC1RAB9ACASP3SENP7 | |
| SCHEMBL1536432 | 0.76 | KDM4E (0.57) | KDM4ENPC1RAB9AMAPTPLAU | |
| SCHEMBL30746959 | 0.76 | KDM4E (0.57) | KDM4ENPC1RAB9AMAPTPLAU | |
| SCHEMBL19798862 | 0.75 | RAB9A (0.41) | KDM4EMEN1KMT2ACYP3A4NPC1 | |
| SCHEMBL12416723 | 0.75 | NPC1 (0.39) | KDM4ECYP3A4NPC1RAB9ACASP3 |
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-116354879-A | Benzamide derivative and application thereof | 中国药科大学 | 2023-06-30 | — | — | CN | disclosed |