Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.52 |
| ▸ | CA6 | P23280 | 4/20 | 0.52 |
| ▸ | CA7 | P43166 | 4/20 | 0.52 |
| ▸ | CA9 | Q16790 | 4/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.52 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA4 | P22748 | 3/20 | 0.52 |
| ▸ | CA5A | P35218 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CA3 | P07451 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | ANPEP | P15144 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11571166 | 1.00 | CA12 (0.52) | CA12CA6CA7CA9CA14 | |
| SCHEMBL14423285 | 1.00 | CA12 (0.52) | CA12CA6CA7CA9CA14 | |
| SCHEMBL1716436 | 0.95 | — | — | |
| Trientine SCHEMBL11135455 | 0.85 | CA12 (0.65) | CA12CA6CA7CA9CA14 | |
| SCHEMBL14356088 | 0.84 | KDM4E (0.39) | CA12CA9LMNACA2TDP1 | |
| Trientine SCHEMBL9564313 | 0.83 | CA12 (0.55) | CA12CA6CA7CA9CA14 | |
| Medronic Acid SCHEMBL3537114 | 0.83 | CA12 (0.55) | CA12CA6CA7CA9CA14 | |
| Medronic Acid SCHEMBL3539311 | 0.83 | CA12 (0.55) | CA12CA6CA7CA9CA14 | |
| Trientine SCHEMBL242925 | 0.83 | CA12 (0.55) | CA12CA6CA7CA9CA14 | |
| Medronic Acid SCHEMBL833821 | 0.83 | CA12 (0.55) | CA12CA6CA7CA9CA14 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4164574-A | Use of polyquaternary ammonium methylene phosphonates as microbiocides | PETROLITE CORPORATION (US) | 1979-08-14 | — | — | US | disclosed |
| US-4084950-A | SCALE INHIBITION, CHELATION | PETROLITE CORPORATION (US) | 1978-04-18 | — | — | US | disclosed |
| US-4075243-A | ANTISCALING, CHELATION, BACTERICIDES | PETROLITE CORPORATION (US) | 1978-02-21 | — | — | US | disclosed |
| US-3966630-A | Use of polyquaternary ammonium methylene phosphonates in chelating or scale inhibition | PETROLITE CORPORATION (US) | 1976-06-29 | — | — | US | disclosed |