Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | TACR3 | P29371 | 9/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ME2 | P23368 | 1/20 | 0.47 |
| ▸ | ME1 | P48163 | 1/20 | 0.47 |
| ▸ | ME3 | Q16798 | 1/20 | 0.47 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8617515 | 0.92 | EPRS1 (0.54) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8615244 | 0.89 | CYP3A4 (0.56) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8617743 | 0.89 | CYP3A4 (0.65) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8615206 | 0.88 | CYP3A4 (0.52) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8620745 | 0.88 | CYP3A4 (0.64) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8617733 | 0.87 | CYP3A4 (0.58) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8618231 | 0.87 | RXFP1 (0.59) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8619386 | 0.87 | LMNA (0.52) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL8614339 | 0.87 | CYP3A4 (0.54) | CYP3A4MEN1KMT2AKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL8614025 | 0.86 | CYP3A4 (0.53) | CYP3A4MEN1KMT2AKDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0726254-B1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS (JP) | 1998-05-06 | — | — | EP | disclosed |
| US-5627193-A | MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-05-06 | — | — | US | disclosed |
| EP-0726254-A1 | Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-08-14 | — | — | EP | disclosed |