Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.47 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL13530009 | 0.88 | POLB (0.42) | CXCR4ANPEPERAP2SIGMAR1POLB | |
| SCHEMBL14467551 | 0.82 | CXCR4 (0.42) | CXCR4ANPEPERAP2SIGMAR1POLB | |
| SCHEMBL8735121 | 0.80 | GRIN2D (0.55) | CXCR4ANPEPERAP2SIGMAR1POLB | |
| SCHEMBL18985137 | 0.79 | CXCR4 (0.43) | CXCR4ANPEPERAP2SIGMAR1POLB | |
| SCHEMBL14444588 | 0.79 | PAOX (0.46) | SIGMAR1POLBKDM4EALDH1A1 | |
| SCHEMBL18985125 | 0.79 | CXCR4 (0.40) | CXCR4ANPEPERAP2SIGMAR1POLB | |
| SCHEMBL18985145 | 0.77 | CXCR4 (0.41) | CXCR4SIGMAR1POLBSMN1; SMN2MEN1 | |
| SCHEMBL14444590 | 0.76 | KEAP1 (0.50) | ANPEPSIGMAR1POLBSMN1; SMN2CYP1A2 | |
| SCHEMBL8614873 | 0.75 | CXCR4 (0.70) | CXCR4SIGMAR1POLBSMN1; SMN2HSD17B10 | |
| SCHEMBL993010 | 0.75 | CXCR4 (0.73) | CXCR4SIGMAR1POLBSMN1; SMN2HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7238679-B2 | Heterocycles and uses thereof | ARIAD PHARMACEUTICALS, INC. (US) | 2007-07-03 | — | — | US | disclosed |