Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | GRK5 | P34947 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 4/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7677006 | 0.81 | ELANE (0.32) | CA2CA9CA12CA1CA4 | |
| SCHEMBL7954706 | 0.78 | ELANE (0.35) | CA2CA9CA12ELANEALDH1A1 | |
| SCHEMBL7686586 | 0.75 | PKM (0.33) | ELANE | |
| SCHEMBL7686476 | 0.67 | GAA (0.35) | CA2CA9CA12LMNAELANE | |
| SCHEMBL7684565 | 0.64 | CA12 (0.45) | CA2CA9CA12CA1CA4 | |
| SCHEMBL23518159 | 0.59 | CA9 (0.41) | CA2CA9CA12LMNAELANE | |
| SCHEMBL7679654 | 0.59 | GAA (0.37) | CA2CA9CA12ELANEGAA | |
| SCHEMBL11093427 | 0.58 | RET (0.45) | CA2CA9CA12CA1CA4 | |
| SCHEMBL28322086 | 0.58 | LMNA (0.37) | CA2CA9CA12CA1CA4 | |
| SCHEMBL7281592 | 0.57 | ELANE (0.58) | CA9CA12CA1RETGRK5 |
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-6346622-B1 | ENANTIOMORPHS AND ISOMERS | ABBOTT LABORATORIES | 2002-02-12 | — | — | US | disclosed |
| CN-1333685-A | Utilisation of I compound for the prophylaxis and therapy of cerebral ischaemia | BASF AG (DE) | 2002-01-30 | — | — | CN | disclosed |
| US-6300354-B1 | FOR THERAPY OF NEUROLEPTIC DISEASES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-09 | — | — | US | disclosed |
| CN-1277607-A | 2-substituted 1,2-benzisothiazole derivatives and their use as serotonin antagonists (5-HT1A, 5-HT1b and 5-HT1D) | BASF AG (DE) | 2000-12-20 | — | — | CN | disclosed |