Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 2/20 | 0.47 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.47 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 2/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.41 |
| ▸ | ALPI | P09923 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | XIAP | P98170 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9160311 | 0.92 | ITGA4 (0.52) | ITGA4ITGB7ATMMMP8POLB | |
| SCHEMBL1595571 | 0.87 | ITGA4 (0.51) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL4909735 | 0.87 | ITGA4 (0.51) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL1595565 | 0.87 | ITGA4 (0.51) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL27580995 | 0.86 | ITGA4 (0.42) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL8071397 | 0.86 | ITGA4 (0.48) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL17202990 | 0.86 | ITGA4 (0.54) | ITGA4ITGB7ATMMMP8POLB | |
| SCHEMBL5711183 | 0.86 | ITGA4 (0.48) | ITGA4ITGB7SRRATMMMP8 | |
| SCHEMBL29107714 | 0.85 | CTSS (0.44) | ITGA4ITGB7MAPTCTSSCTSK | |
| SCHEMBL27941871 | 0.85 | CTSS (0.44) | ITGA4ITGB7MAPTCTSSCTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1526134-A2 | TRIAZOLYL TROPANE DERIVATIVES AS CCR5 MODULATORS | Pfizer Limited (GB) | 2005-04-27 | — | — | EP | disclosed |
| EP-1013276-A1 | Aminoazacycloalkanes as CCR5 modulators | PFIZER INC. (US) | 2000-06-28 | — | — | EP | disclosed |