Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8186274 | 0.80 | ALDH1A1 (0.44) | MGLLNOTUMALDH1A1POLB | |
| SCHEMBL8178332 | 0.80 | GSK3A (0.50) | CYP1A2ALDH1A1GAAKMT2AMEN1 | |
| SCHEMBL8177807 | 0.79 | NOTUM (0.41) | CYP1A2NOTUMALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL8177459 | 0.79 | CYP1A2 (0.74) | CYP1A2MGLLNOTUMALDH1A1POLB | |
| SCHEMBL17537374 | 0.72 | FAAH (0.59) | CYP1A2FAAHMGLLNOTUMALDH1A1 | |
| SCHEMBL8185793 | 0.70 | CYP1A2 (0.54) | CYP1A2NOTUMALDH1A1POLBRAB9A | |
| SCHEMBL8187626 | 0.70 | CYP2C9 (0.74) | CYP1A2GAAMAPT | |
| SCHEMBL23931446 | 0.69 | HTT (0.65) | FAAHMGLLNOTUMALDH1A1POLB | |
| SCHEMBL8177088 | 0.69 | MAPK8 (0.53) | NOTUMALDH1A1POLBGAAMAPT | |
| SCHEMBL8187437 | 0.69 | BRD9 (0.50) | ALDH1A1POLBMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008118626-A9 | INHIBITORS OF JNK AND METHODS FOR IDENTIFYING INHIBITORS OF JNK | BURNHAM INST MEDICAL RESEARCH (US) | 2008-12-18 | — | — | WO | disclosed |
| WO-2008118626-A2 | INHIBITORS OF JNK AND METHODS FOR IDENTIFYING INHIBITORS OF JNK | BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) | 2008-10-02 | — | — | WO | disclosed |