Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.38 |
| ▸ | CA9 | Q16790 | 4/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14472549 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL6280678 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL254392 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL1509203 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL239520 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL307800 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL15752289 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL8355844 | 1.00 | CA12 (0.38) | CA12CA9CA1CA2TSHR | |
| SCHEMBL254386 | 0.86 | CA12 (0.42) | CA12CA9CA1CA2TSHR | |
| SCHEMBL11548381 | 0.86 | CA12 (0.42) | CA12CA9CA1CA2TSHR |
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-5576430-A | 1,8-diazabicyclo[5.4.0]undec-1(7)-enium cyanide and method of making thereof | GLAXO WELLCOME INC. (US) | 1996-11-19 | — | — | US | disclosed |
| US-5329008-A | Synthesis of a 3,4-dihydroxy-1-cyclopentanylpurinone | GLAXO INC. (US) | 1994-07-12 | — | — | US | disclosed |