Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CTSA | P10619 | 14/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8050089 | 0.82 | SMN1; SMN2 (0.58) | MEN1GAAKMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL4330530 | 0.74 | CTSA (0.43) | CTSACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL9705564 | 0.72 | CYP3A4 (0.49) | MEN1GAAKMT2ASMN1; SMN2CYP1A2 | |
| SCHEMBL4327564 | 0.71 | CTSA (0.43) | CTSACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4334693 | 0.71 | CTSA (0.43) | CTSACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4325302 | 0.70 | FPR2 (0.38) | MEN1KMT2ACTSACYP1A2CYP3A4 | |
| SCHEMBL4329554 | 0.69 | CTSA (0.43) | CTSAPKM | |
| SCHEMBL4322245 | 0.69 | SLC6A9 (0.45) | CTSACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4332670 | 0.69 | SLC6A9 (0.45) | CTSACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4331310 | 0.69 | CTSA (0.43) | CTSAPKM |
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-0749957-B1 | Aromatic hydroxamic acid compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2000-04-26 | — | — | EP | disclosed |
| US-5891916-A | ANTINEUROGEGERATIVE AGENT | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-04-06 | — | — | US | disclosed |
| EP-0749957-A1 | Aromatic hydroxamic acid compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1996-12-27 | — | — | EP | disclosed |