Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RUVBL1 | Q9Y265 | 1/20 | 0.56 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.56 |
| ▸ | TACR3 | P29371 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8617534 | 0.89 | CA12 (0.64) | RUVBL1TRPV1TACR3CYP3A4KDM4E | |
| SCHEMBL8615804 | 0.89 | KDM4E (0.64) | RUVBL1TRPV1TACR3CYP3A4KDM4E | |
| SCHEMBL8617743 | 0.88 | CYP3A4 (0.65) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| SCHEMBL8614006 | 0.87 | KDM4E (0.60) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8620745 | 0.87 | CYP3A4 (0.64) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8620121 | 0.86 | KDM4E (0.59) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| SCHEMBL8620931 | 0.86 | POLB (0.66) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| SCHEMBL8615244 | 0.86 | CYP3A4 (0.56) | TACR3CYP3A4KDM4EMEN1ALDH1A1 | |
| SCHEMBL8616671 | 0.86 | TRPV1 (0.55) | RUVBL1TRPV1TACR3CYP3A4KDM4E | |
| SCHEMBL8617544 | 0.85 | MEN1 (0.60) | TACR3CYP3A4KDM4EMEN1ALDH1A1 |
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 |