Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA6 | P23280 | 3/20 | 0.34 |
| ▸ | CA7 | P43166 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 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 | |
|---|---|---|---|---|
| SCHEMBL17187510 | 0.91 | KDM4E (0.50) | ACE2KDM4EALDH1A1RECQL | |
| SCHEMBL11839292 | 0.82 | KDM4E (0.39) | KDM4EALDH1A1 | |
| SCHEMBL7869498 | 0.81 | — | — | |
| SCHEMBL11812600 | 0.79 | ACE2 (0.42) | ACE2KDM4EALDH1A1CA12CA6 | |
| SCHEMBL8143727 | 0.78 | KDM4E (0.49) | KDM4EALDH1A1 | |
| SCHEMBL18198890 | 0.77 | KDM4E (0.45) | KDM4EALDH1A1RECQL | |
| SCHEMBL21089234 | 0.76 | KDM4E (0.52) | KDM4EALDH1A1LMNATP53 | |
| SCHEMBL1029410 | 0.74 | ACE2 (0.38) | ACE2ALDH1A1MEN1KMT2A | |
| SCHEMBL10578535 | 0.74 | ACE2 (0.38) | ACE2ALDH1A1MEN1KMT2A | |
| SCHEMBL10579933 | 0.74 | ACE2 (0.38) | ACE2ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-9944844-B2 | Constraining pyrite activity in shale | SMART CHEMICAL SERVICES, LP (US) | 2018-04-17 | — | — | US | disclosed |
| US-20160251569-A1 | Constraining Pyrite Activity in Shale | AMARILLO NATIONAL BANK | 2016-09-01 | — | — | US | disclosed |
| US-9309453-B2 | Constraining pyrite activity in shale | SMART CHEMICAL SERVICES, LP (US) | 2016-04-12 | — | — | US | disclosed |
| US-8895482-B2 | Constraining pyrite activity in shale | SMART CHEMICAL SERVICES, LP (US) | 2014-11-25 | — | — | US | disclosed |
| US-20130284427-A1 | Constraining Pyrite Activity in Shale | SMART CHEMICAL SERVICES, LP (US) | 2013-10-31 | — | — | US | disclosed |
| US-20130035264-A1 | Constraining Pyrite Activity in Shale | AMARILLO NATIONAL BANK | 2013-02-07 | — | — | US | disclosed |