Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 4/20 | 0.35 |
| ▸ | CASP6 | P55212 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 7/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | MEN1 | O00255 | 5/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | BLM | P54132 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | NOS2 | P35228 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3728212 | 0.81 | TSHR (0.37) | TDP1NOS1CASP6MAPTALDH1A1 | |
| SCHEMBL32679425 | 0.81 | TSHR (0.37) | TDP1NOS1CASP6MAPTALDH1A1 | |
| SCHEMBL6052169 | 0.80 | GPR35 (0.44) | TDP1NOS1CASP6MAPTALDH1A1 | |
| SCHEMBL27647699 | 0.80 | TDP1 (0.44) | TDP1NOS1MAPTALDH1A1MEN1 | |
| SCHEMBL3730228 | 0.80 | MAPT (0.40) | TDP1NOS1CASP6MAPTALDH1A1 | |
| Silver SCHEMBL9168054 | 0.79 | GPR35 (0.43) | TDP1NOS1CASP6MAPTALDH1A1 | |
| SCHEMBL9168064 | 0.79 | GPR35 (0.43) | TDP1NOS1CASP6MAPTALDH1A1 | |
| SCHEMBL6052000 | 0.76 | TDP1 (0.43) | TDP1CASP6MAPTALDH1A1MEN1 | |
| SCHEMBL103130 | 0.76 | NOS1 (0.51) | TDP1NOS1MAPTALDH1A1MEN1 | |
| Silver SCHEMBL9169439 | 0.75 | MAPT (0.33) | TDP1NOS1CASP6MAPTALDH1A1 |
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-0855391-B1 | NOVEL ISOQUINOLINE DERIVATIVES | DAIICHI SEIYAKU CO (JP) | 2003-10-15 | — | — | EP | disclosed |
| US-5959107-A | Isoquinoline derivatives | SNOW BRAND MILK PRODUCTS CO., LTD. (JP) | 1999-09-28 | — | — | US | disclosed |
| EP-0855391-A1 | NOVEL ISOQUINOLINE DERIVATIVES | SNOW BRAND MILK PRODUCTS CO., LTD. (JP) | 1998-07-29 | — | — | EP | disclosed |