Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 3/20 | 0.42 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 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 | |
|---|---|---|---|---|
| SCHEMBL8614946 | 0.92 | ALDH1A1 (0.43) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8615326 | 0.86 | MEN1 (0.45) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8620920 | 0.82 | TACR3 (0.43) | TACR3 | |
| SCHEMBL8617855 | 0.81 | DHODH (0.47) | TACR3ALDH1A1MEN1CYP1A2CYP2C9 | |
| SCHEMBL8619780 | 0.81 | ADORA3 (0.47) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8613501 | 0.80 | CA9 (0.45) | TACR3ALDH1A1MEN1CYP3A4KMT2A | |
| SCHEMBL8614054 | 0.80 | KMT2A (0.51) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8618942 | 0.79 | ACLY (0.45) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8617819 | 0.79 | ACLY (0.42) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 | |
| SCHEMBL8618116 | 0.78 | ADORA1 (0.47) | TACR3ALDH1A1MEN1CYP1A2CYP3A4 |
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 |