Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | WNT1 | P04628 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12629144 | 0.83 | KMT2A (0.47) | KMT2AKDM4EALDH1A1SCN9ASCN10A | |
| SCHEMBL12629018 | 0.82 | KMT2A (0.44) | KMT2AKDM4EALDH1A1SCN9ASCN10A | |
| SCHEMBL9266166 | 0.82 | SLC6A9 (0.34) | SCN9A | |
| SCHEMBL21427218 | 0.79 | KMT2A (0.41) | KMT2AKDM4EALDH1A1SCN9ASCN10A | |
| SCHEMBL21766563 | 0.76 | DRD2 (0.44) | KMT2AALDH1A1DRD2 | |
| SCHEMBL12693934 | 0.74 | KMT2A (0.40) | KMT2AKDM4EALDH1A1SCN9ASCN10A | |
| SCHEMBL12342818 | 0.72 | ALDH1A1 (0.49) | KMT2AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5556103 | 0.72 | ALDH1A1 (0.38) | KMT2AALDH1A1SMN1; SMN2DRD2WNT1 | |
| SCHEMBL5555248 | 0.72 | WNT1 (0.37) | KMT2AKDM4EALDH1A1SCN9ASCN10A | |
| SCHEMBL12450076 | 0.72 | KMT2A (0.38) | KMT2AKDM4EALDH1A1SCN9ASCN10A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5403572-A | Macrocyclic polyaza compounds containing 5 or 6 membered rings, process for producing them and pharmaceutical media containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-04-04 | — | — | US | disclosed |
| US-5334371-A | Marcocyclic polyaza bicyclo compounds containing 5 or 6 membered rings, and method for MRI | SCHERING AKTIENGESELLSCHAFT (DE) | 1994-08-02 | — | — | US | disclosed |