Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28981186 | 0.85 | LTA4H (0.46) | LTA4HEPHX2POLBHDAC1CA1 | |
| SCHEMBL9849286 | 0.83 | LMNA (0.42) | LTA4HEPHX2LMNAPOLBHDAC1 | |
| SCHEMBL12676950 | 0.78 | TAAR1 (0.48) | LTA4HEPHX2POLBCA1CA2 | |
| SCHEMBL16407595 | 0.77 | LTA4H (0.45) | LTA4HEPHX2POLBCA1CA2 | |
| SCHEMBL17714648 | 0.75 | CYP4A11 (0.46) | LTA4HEPHX2POLBCA2MEN1 | |
| SCHEMBL6829825 | 0.75 | TDP1 (0.49) | LTA4HEPHX2POLBCA1CA2 | |
| SCHEMBL7221428 | 0.75 | EPHX2 (0.53) | LTA4HEPHX2LMNAPOLBHDAC1 | |
| SCHEMBL16407450 | 0.74 | ENPP2 (0.45) | LTA4HEPHX2POLBCA1CA2 | |
| SCHEMBL7745491 | 0.74 | POLB (0.47) | LTA4HEPHX2POLBHDAC1CA1 | |
| SCHEMBL16244405 | 0.74 | LMNA (0.53) | LMNACA1CA2ALOX15TDP1 |
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-0421436-A2 | Substituted carboxytetrahydroisoquinolines and derivatives thereof having pharmaceutical activity | WARNER-LAMBERT COMPANY (US) | 1991-04-10 | — | — | EP | claimed |
| EP-0421436-A2 | Substituted carboxytetrahydroisoquinolines and derivatives thereof having pharmaceutical activity | WARNER-LAMBERT COMPANY (US) | 1991-04-10 | — | — | EP | disclosed |