Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SGK1 | O00141 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | MAP2K4 | P45985 | 2/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 6/20 | 0.37 |
| ▸ | GAK | O14976 | 2/20 | 0.37 |
| ▸ | STK16 | O75716 | 2/20 | 0.37 |
| ▸ | BMP2K | Q9NSY1 | 2/20 | 0.37 |
| ▸ | ACP1 | P24666 | 3/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | TACR3 | P29371 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8615149 | 0.85 | ALDH1A1 (0.49) | ACP1ABCB1ABCC1ABCG2TACR3 | |
| SCHEMBL8617822 | 0.82 | ACLY (0.38) | ACP1ACLYABCB1ABCC1ABCG2 | |
| SCHEMBL8617828 | 0.81 | DHODH (0.45) | ACP1ABCB1ABCC1ABCG2TACR3 | |
| SCHEMBL8613247 | 0.81 | ALDH1A1 (0.44) | ACP1ABCB1ABCC1ABCG2TACR3 | |
| SCHEMBL8618955 | 0.81 | ACLY (0.41) | AAK1GAKSTK16BMP2KACP1 | |
| SCHEMBL8619887 | 0.81 | DHODH (0.47) | ACP1ABCB1ABCC1ABCG2TACR3 | |
| SCHEMBL8618223 | 0.80 | ALDH1A1 (0.41) | AAK1GAKSTK16BMP2KACP1 | |
| SCHEMBL8612679 | 0.80 | ABCB1 (0.55) | ABCB1ABCC1ABCG2TACR3KDM4E | |
| SCHEMBL8619389 | 0.79 | TACR3 (0.41) | ACP1ABCB1ABCC1ABCG2TACR3 | |
| SCHEMBL8613743 | 0.78 | ALDH1A1 (0.53) | ABCB1ABCC1ABCG2KDM4EALDH1A1 |
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 |