Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.48 |
| ▸ | MLYCD | O95822 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3152403 | 0.94 | ADRA2C (0.55) | ADRA2CPHLPP2HPGDALDH1A1MEN1 | |
| SCHEMBL8725845 | 0.85 | ADRA2C (0.51) | ADRA2CMLYCDHPGDALDH1A1ADRB2 | |
| SCHEMBL11506841 | 0.84 | ALDH1A1 (0.63) | ADRA2CMLYCDHPGDALDH1A1ADRB2 | |
| SCHEMBL7375547 | 0.83 | HPGD (0.64) | ADRA2CHPGDALDH1A1MEN1KMT2A | |
| SCHEMBL4483065 | 0.82 | MLYCD (0.46) | ADRA2CPHLPP2MLYCDALDH1A1KMT2A | |
| SCHEMBL11506563 | 0.81 | ADRA2C (0.58) | ADRA2CMLYCDHPGDALDH1A1ADRB2 | |
| SCHEMBL6776066 | 0.80 | ADRA2C (0.50) | ADRA2CMLYCDHPGDALDH1A1ADRB2 | |
| SCHEMBL9716701 | 0.80 | ADRA2C (0.55) | ADRA2CMLYCDHPGDALDH1A1MEN1 | |
| SCHEMBL7288882 | 0.80 | ADRA2C (0.69) | ADRA2CMLYCDHPGDALDH1A1ADRB2 | |
| SCHEMBL3156492 | 0.79 | CNR2 (0.49) | ALDH1A1MEN1KMT2ASMN1; SMN2TP53 |
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-0832091-A1 | C-4' MODIFIED ADENOSINE KINASE INHIBITORS | GENSIA, INC. (US) | 1998-04-01 | — | — | EP | disclosed |
| WO-1996040705-A1 | C-4' MODIFIED ADENOSINE KINASE INHIBITORS | GENSIA SICOR (US) | 1996-12-19 | — | — | WO | disclosed |