Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | TYK2 | P29597 | 2/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 4/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1176680 | 1.00 | CHEK1 (0.41) | CHEK1JAK2JAK1TYK2JAK3 | |
| Formic Acid SCHEMBL5562022 | 0.96 | CHEK1 (0.38) | CHEK1JAK2JAK1TYK2JAK3 | |
| SCHEMBL1176539 | 0.93 | DYRK1A (0.40) | CHEK1BACE1GSK3BDYRK1ACLK2 | |
| SCHEMBL5046675 | 0.93 | DYRK1A (0.40) | CHEK1BACE1GSK3BDYRK1ACLK2 | |
| Formic Acid SCHEMBL5562045 | 0.89 | DYRK1A (0.38) | CHEK1GSK3BDYRK1ACLK2CLK3 | |
| SCHEMBL1176152 | 0.88 | JAK2 (0.38) | JAK2JAK1TYK2JAK3USP30 | |
| SCHEMBL5039448 | 0.88 | JAK2 (0.38) | JAK2JAK1TYK2JAK3USP30 | |
| SCHEMBL1176462 | 0.86 | CDK2 (0.48) | CHEK1JAK2JAK1TYK2JAK3 | |
| SCHEMBL1176466 | 0.86 | CDK2 (0.48) | CHEK1JAK2JAK1TYK2JAK3 | |
| SCHEMBL5042765 | 0.84 | GRM5 (0.40) | JAK2JAK1TYK2JAK3USP30 |
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 |
|---|---|---|---|---|---|---|---|
| US-7396833-B2 | Indoles, 1H-indazoles, 1,2-benzisoxazoles, and 1,2-benzisothiazoles, and preparation and uses thereof | MEMORY PHARMACEUTICALS CORPORATION (US) | 2008-07-08 | — | — | US | claimed |
| EP-1697378-B1 | INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF | MEMORY PHARM CORP (US) | 2007-11-21 | — | — | EP | claimed |