Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OGG1 | O15527 | 1/20 | 0.37 |
| ▸ | SHBG | P04278 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27808388 | 0.82 | PARP1 (0.39) | SMN1; SMN2KMT2AMEN1RECQLKIF11 | |
| SCHEMBL27828803 | 0.82 | ALDH1A1 (0.37) | CYP2D6TSHRSMN1; SMN2KMT2ANPC1 | |
| SCHEMBL27828850 | 0.78 | RAB9A (0.38) | CYP2D6CYP2C9CYP2C19SMN1; SMN2CYP3A4 | |
| SCHEMBL28652779 | 0.78 | CYP2D6 (0.40) | OGG1CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL2491151 | 0.77 | CYP3A4 (0.48) | CYP2D6CYP2C9TSHRCYP2C19CYP3A4 | |
| SCHEMBL18039462 | 0.77 | OGG1 (0.39) | OGG1CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL2491152 | 0.77 | GRIN2D (0.49) | OGG1SMN1; SMN2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL18530405 | 0.75 | CYP2D6 (0.38) | OGG1CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL18530402 | 0.75 | CYP2D6 (0.38) | OGG1CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL27532961 | 0.74 | TAAR1 (0.40) | SMN1; SMN2KMT2ANPC1MEN1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101970435-A | Pyrrolopyrimidines and pyrrolopyridines | NOVARTIS AG | 2011-02-09 | — | — | CN | disclosed |