Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | LMNA | P02545 | 4/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CNR1 | P21554 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8616663 | 0.96 | ALDH1A1 (0.60) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| SCHEMBL8616268 | 0.91 | KMT2A (0.62) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| SCHEMBL8620889 | 0.90 | HTT (0.61) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| Hydrochloric Acid SCHEMBL8619430 | 0.89 | HTT (0.60) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| SCHEMBL8618197 | 0.86 | ALDH1A1 (0.49) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| SCHEMBL8615354 | 0.85 | CYP3A4 (0.65) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL8619295 | 0.84 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8618111 | 0.84 | CYP3A4 (0.64) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL8615869 | 0.84 | PTGER4 (0.57) | ALDH1A1HPGDKDM4EMAPTLMNA | |
| SCHEMBL8618943 | 0.83 | MEN1 (0.65) | ALDH1A1HPGDKDM4EMAPTLMNA |
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 |