Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 7/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.60 |
| ▸ | HTT | P42858 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8619247 | 0.96 | TP53 (0.60) | TP53KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL8615354 | 0.88 | CYP3A4 (0.65) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8618111 | 0.87 | CYP3A4 (0.64) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL8617743 | 0.87 | CYP3A4 (0.65) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| SCHEMBL8618943 | 0.86 | MEN1 (0.65) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL8618936 | 0.86 | CYP3A4 (0.56) | KDM4EALDH1A1HPGDMAPTHTT | |
| SCHEMBL8619782 | 0.86 | CYP3A4 (0.55) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL8620745 | 0.86 | CYP3A4 (0.64) | KDM4EALDH1A1HPGDSMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL8613665 | 0.85 | MEN1 (0.64) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL8615869 | 0.85 | PTGER4 (0.57) | KDM4EALDH1A1HPGDMAPTSMN1; SMN2 |
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 |