Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.36 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5848976 | 0.94 | CTSS (0.39) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL23854685 | 0.70 | AAK1 (0.38) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL25905710 | 0.70 | CTSK (0.37) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL28535891 | 0.69 | ACACB (0.43) | CTSSCTSKCA2CA1CA7 | |
| SCHEMBL31456042 | 0.69 | HTR2A (0.43) | CTSSCTSKAAK1 | |
| SCHEMBL30346690 | 0.68 | CTSS (0.49) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL6500860 | 0.68 | SSTR4 (0.36) | AAK1 | |
| SCHEMBL29280782 | 0.68 | CTSS (0.49) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL27421061 | 0.68 | CTSS (0.49) | CTSSCTSKAAK1CA2CA1 | |
| SCHEMBL25905691 | 0.68 | CYP3A4 (0.36) | AAK1CA2CA1CA7CA4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006054151-A1 | SYNTHESIS OF 5-BROMO-4-METHYL-PYRIDIN-3-YLMETHYL)-ETHYL-CARBAMIC ACID TERT-BUTYL ESTER | PFIZER INC., (US) | 2006-05-26 | — | — | WO | disclosed |
| EP-1658284-A1 | 3,5 DISUBSTITUTED INDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR MEDIATING OR INHIBITING CELL PROLIFERATION | PFIZER INC. (US) | 2006-05-24 | — | — | EP | disclosed |
| WO-2006024945-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING A CDK INHIBITOR | PFIZER INC. (US) | 2006-03-09 | — | — | WO | disclosed |
| WO-2005009997-A1 | 3,5 DISUBSTITUTED INDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR MEDIATING OR INHIBITING CELL PROLIFERATION | PFIZER INC. (US) | 2005-02-03 | — | — | WO | disclosed |