Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7494626 | 0.74 | SIGMAR1 (0.47) | SIGMAR1POLBLMNAGAAL3MBTL1 | |
| SCHEMBL14595220 | 0.73 | SIGMAR1 (0.48) | SIGMAR1ALDH1A1POLBCYP2D6CYP2C9 | |
| SCHEMBL2805436 | 0.71 | CCR2 (0.39) | SIGMAR1ALDH1A1KMT2APOLBCYP2D6 | |
| SCHEMBL22092518 | 0.71 | NOTUM (0.40) | SIGMAR1ALDH1A1KMT2APOLBCYP2D6 | |
| SCHEMBL4888487 | 0.69 | NOTUM (0.41) | SIGMAR1ALDH1A1KMT2APOLBCYP2D6 | |
| SCHEMBL7940102 | 0.68 | GSK3A (0.37) | SIGMAR1ALDH1A1KMT2APOLBCYP2D6 | |
| SCHEMBL11136071 | 0.68 | SLC6A1 (0.57) | SIGMAR1ALDH1A1KMT2ACYP2D6CYP2C9 | |
| Acetic Acid SCHEMBL28332665 | 0.67 | CYP2D6 (0.49) | ALDH1A1KMT2APOLBCYP2D6CYP2C9 | |
| SCHEMBL28039452 | 0.67 | SIGMAR1 (0.47) | SIGMAR1ALDH1A1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL2228270 | 0.66 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1POLBLMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2888247-A1 | SERINE/THREONINE KINASE INHIBITORS FOR THE TREATMENT OF HYPERPROLIFERATIVE!DISEASES | Array Biopharma, Inc. (US) | 2015-07-01 | — | — | EP | disclosed |
| WO-2014036015-A1 | SERINE/THREONINE KINASE INHIBITORS FOR THE TREATMENT OF HYPERPROLIFERATIVE|DISEASES | ARRAY BIOPHARMA INC. (US) | 2014-03-06 | — | — | WO | disclosed |