Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 6/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7845566 | 0.86 | KDM1A (0.47) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL7836868 | 0.80 | KDM1A (0.43) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL7842311 | 0.80 | KDM1A (0.46) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL7999981 | 0.80 | MEN1 (0.45) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL7689595 | 0.70 | KDM1A (0.57) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL7826829 | 0.69 | KDM1A (0.43) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL28613370 | 0.67 | KDM1A (0.49) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL28618474 | 0.66 | ALDH1A1 (0.50) | KDM1AKMT2AKDM4EALDH1A1MEN1 | |
| SCHEMBL4557943 | 0.65 | KDM1A (0.47) | KDM1AKMT2AKDM4EALDH1A1CYP1A2 | |
| SCHEMBL7845574 | 0.65 | MEN1 (0.48) | KMT2AKDM4EALDH1A1MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-6288082-B1 | COMPOUNDS SUCH AS 6,7-DIETHOXY-4-(INDAN-5-YLAMINO) -QUINOLINE-3-CARBONITRILE USED AS ANTINEOPLASTIC AGENTS AND IN THE TREATMENT OF POLYCYCSTIC KIDNEY DISEASE | AMERICAN CYANAMID COMPANY | 2001-09-11 | — | — | US | disclosed |