Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.61 |
| ▸ | CA1 | P00915 | 4/20 | 0.61 |
| ▸ | FOLH1 | Q04609 | 7/20 | 0.56 |
| ▸ | ALB | P02768 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | DHFR | P00374 | 2/20 | 0.48 |
| ▸ | RIMKLA | Q8IXN7 | 1/20 | 0.47 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.47 |
| ▸ | TYMS | P04818 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27564186 | 0.88 | CA2 (0.75) | CA2CA1FOLH1CA12CA9 | |
| SCHEMBL15905507 | 0.86 | CA2 (0.61) | CA2CA1FOLH1CA12CA9 | |
| SCHEMBL9213624 | 0.86 | CA2 (0.61) | CA2CA1FOLH1CA12CA9 | |
| SCHEMBL2246705 | 0.85 | CA2 (0.60) | CA2CA1FOLH1ALB | |
| SCHEMBL2246702 | 0.85 | MMP12 (0.60) | CA2CA1FOLH1ALBCA12 | |
| SCHEMBL14719929 | 0.85 | ALB (0.51) | CA2CA1FOLH1ALBCA12 | |
| SCHEMBL20299919 | 0.84 | CA2 (0.60) | CA2CA1ALBCA12CA9 | |
| SCHEMBL20299916 | 0.84 | CA2 (0.60) | CA2CA1ALBCA12CA9 | |
| SCHEMBL31485787 | 0.83 | FOLH1 (0.74) | FOLH1ALB | |
| SCHEMBL698067 | 0.82 | CA2 (0.67) | CA2CA1FOLH1CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4988813-A | Process for the preparation of fused pyridine compounds | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1991-01-29 | — | — | US | claimed |
| US-20070260028-A1 | Novel Polyacetylene Derivatives | JAPN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2007-11-08 | — | — | US | disclosed |
| EP-1795545-A1 | NOVEL POLYACETYLENE DERIVATIVES | Japan Science and Technology Agency (JP) | 2007-06-13 | — | — | EP | disclosed |