Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA7 | P43166 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | TPMT | P51580 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | CA6 | P23280 | 2/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SELL | P14151 | 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 | |
|---|---|---|---|---|
| SCHEMBL5141318 | 0.98 | CA12 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17354771 | 0.92 | RARB (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23346265 | 0.90 | CA12 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17354677 | 0.90 | MRGPRX4 (0.37) | CA12CA1CA2CA7CA9 | |
| SCHEMBL16749633 | 0.87 | CA12 (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15521778 | 0.84 | DHODH (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL18604545 | 0.84 | RARB (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17354675 | 0.84 | RARB (0.44) | MRGPRX4NR4A1 | |
| SCHEMBL10411989 | 0.83 | TPMT (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10412427 | 0.83 | TPMT (0.61) | CA12CA1CA2CA7CA9 |
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-11007516-B1 | Tunable metal-organic framework compositions and methods thereof | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) | 2021-05-18 | — | — | US | disclosed |
| US-9216939-B2 | Metal-organic framework materials with ultrahigh surface areas | NORTHWESTERN UNIVERSITY (US) | 2015-12-22 | — | — | US | disclosed |