Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.55 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MOK | Q9UQ07 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8617766 | 0.93 | ABCB1 (0.54) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8619415 | 0.90 | ABCB1 (0.47) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8615149 | 0.87 | ALDH1A1 (0.49) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8613684 | 0.87 | NPC1 (0.42) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8617739 | 0.86 | ALDH1A1 (0.47) | ABCB1ABCC1ABCG2ALDH1A1HSD17B10 | |
| SCHEMBL8617753 | 0.85 | ACP1 (0.51) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8615210 | 0.84 | TACR3 (0.44) | ABCB1ABCC1ABCG2KMT2AMEN1 | |
| SCHEMBL8619389 | 0.84 | TACR3 (0.41) | ABCB1ABCC1ABCG2ALDH1A1HSD17B10 | |
| SCHEMBL8615938 | 0.84 | TACR3 (0.41) | ABCB1ABCC1ABCG2KMT2ATACR3 | |
| SCHEMBL8618234 | 0.84 | RXFP1 (0.44) | ABCB1ABCC1ABCG2ALDH1A1RXFP1 |
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 |