Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | CA7 | P43166 | 1/20 | 0.67 |
| ▸ | CA9 | Q16790 | 1/20 | 0.67 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4813146 | 0.98 | CA12 (0.69) | CA12CA1CA2CA7CA9 | |
| Pyridine SCHEMBL28444914 | 0.86 | CA12 (0.55) | CA12CA1CA2CA7CA9 | |
| SCHEMBL536507 | 0.83 | CA12 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2516078 | 0.81 | ALDH1A1 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL398360 | 0.80 | CA1 (1.00) | CA12CA1CA2CA7CA9 | |
| Sulfuric Acid SCHEMBL9350034 | 0.80 | CA12 (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL8989972 | 0.80 | CA12 (0.69) | CA12CA1CA2CA7CA9 | |
| SCHEMBL3725957 | 0.80 | CA12 (0.69) | CA12CA1CA2CA7CA9 | |
| SCHEMBL26900 | 0.79 | CA12 (0.63) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7178959 | 0.79 | MMP1 (0.46) | 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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2160352-A2 | METHOD FOR THE PRODUCTION OF BINARY CLATHRATE HYDRATES OF HYDROGEN | Arca, Simone (IT) | 2010-03-10 | — | — | EP | disclosed |
| WO-2008142560-A2 | METHOD FOR THE PRODUCTION OF BINARY CLATHRATE HYDRATES OF HYDROGEN | ARCA SIMONE (IT) | 2008-11-27 | — | — | WO | disclosed |
| US-5578633-A | VASOPRESSIN AND OXYTOCIN ANTAGONISTS | SANOFI (FR) | 1996-11-26 | — | — | US | disclosed |
| US-5481005-A | N-sulfonylindoline derivatives, their preparation and the pharmaceutical compositions in which they are present | SANOFI (FR) | 1996-01-02 | — | — | US | disclosed |
| US-5397801-A | Affinity for vasopressin and ocytocin receptors; disorders of nervous, cardiovascular and gastrointestinal systems | SANOFI (FR) | 1995-03-14 | — | — | US | disclosed |
| US-5338755-A | Have affinity for vasopressin and ocytocin receptors; intermediates for drugs that act on central nervous system | ELF SANOFI (FR) | 1994-08-16 | — | — | US | disclosed |