Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.34 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.34 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.34 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.34 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1789520 | 0.84 | PKM (0.42) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL20269159 | 0.76 | NPC1 (0.51) | KMT2ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL1237453 | 0.74 | KMT2A (0.42) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL651370 | 0.74 | ORAI1 (0.42) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL1672441 | 0.73 | ORAI1 (0.46) | CA4CA6CA5ACA7ENPP2 | |
| Hydrochloric Acid SCHEMBL3987325 | 0.73 | KMT2A (0.41) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL28664851 | 0.71 | TRPV6 (0.44) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL6830675 | 0.71 | TDP1 (0.55) | MAOBTDP1TSHRATML3MBTL1 | |
| SCHEMBL4763196 | 0.70 | TSHR (0.38) | CA4CA6CA5ACA7ENPP2 | |
| SCHEMBL20916961 | 0.70 | LMNA (0.54) | CA4CA6CA5ACA7ENPP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012068081-A1 | INTRAESOPHAGEAL ADMINISTRATION OF TARGETED NITROXIDE AGENTS FOR PROTECTION AGAINST IONIZING IRRADIATION-INDUCED ESOPHAGATIS | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2012-05-24 | — | — | WO | disclosed |
| WO-2010141824-A2 | USE OF TARGETED NITROXIDE AGENTS IN BONE HEALING | UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2010-12-09 | — | — | WO | disclosed |