Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 12/20 | 0.52 |
| ▸ | CA9 | Q16790 | 10/20 | 0.52 |
| ▸ | CA1 | P00915 | 9/20 | 0.52 |
| ▸ | CA12 | O43570 | 6/20 | 0.52 |
| ▸ | CA6 | P23280 | 4/20 | 0.52 |
| ▸ | CA5A | P35218 | 4/20 | 0.52 |
| ▸ | CA4 | P22748 | 3/20 | 0.52 |
| ▸ | CA7 | P43166 | 3/20 | 0.52 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31515794 | 1.00 | CA2 (0.52) | CA2CA9CA1CA12CA6 | |
| SCHEMBL10529086 | 0.84 | CA2 (0.54) | CA2CA9CA1CA12CA6 | |
| SCHEMBL529620 | 0.80 | HTR6 (0.60) | CA2CA9CA1CA12CA6 | |
| SCHEMBL29581383 | 0.80 | HTR6 (0.60) | CA2CA9CA1CA12CA6 | |
| SCHEMBL27381442 | 0.80 | CA2 (0.50) | CA2CA9CA1CA12CA6 | |
| Hydrochloric Acid SCHEMBL4910433 | 0.78 | HTR6 (0.58) | CA2CA9CA1CA12CA6 | |
| Hydrochloric Acid SCHEMBL29713481 | 0.78 | HTR6 (0.58) | CA2CA9CA1CA12CA6 | |
| SCHEMBL202947 | 0.77 | CA2 (0.70) | CA2CA9CA1CA12CA6 | |
| SCHEMBL11572725 | 0.77 | CA2 (0.49) | CA2CA9CA1CA12CA6 | |
| SCHEMBL17595937 | 0.77 | CA2 (0.47) | CA2CA9CA1CA12CA6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4791205-A | OPTICAL BRIGHTENERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-12-13 | — | — | US | disclosed |
| EP-0246551-A2 | Bis-benzoxazolylnaphthalenes containing sulfonate or sulfonamide groups, process for their preparation, and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-11-25 | — | — | EP | disclosed |