Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 5/20 | 0.50 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8210407 | 0.86 | KMT2A (0.53) | KMT2ACYP2C19SMN1; SMN2HTTLMNA | |
| SCHEMBL8199058 | 0.84 | THRB (0.52) | KMT2ACYP1A2CYP2C19SMN1; SMN2HTT | |
| SCHEMBL8211454 | 0.84 | KMT2A (0.51) | KMT2ACYP1A2CYP2C19SMN1; SMN2HTT | |
| SCHEMBL8210271 | 0.80 | KMT2A (0.57) | KMT2ASMN1; SMN2LMNAALDH1A1L3MBTL1 | |
| SCHEMBL7889273 | 0.78 | FAAH (0.48) | KMT2ALMNACHRM4ALDH1A1L3MBTL1 | |
| SCHEMBL8209522 | 0.78 | TDP1 (0.60) | KMT2ASMN1; SMN2LMNACHRM4ALDH1A1 | |
| SCHEMBL8207980 | 0.77 | GAA (0.55) | KMT2ALMNAMEN1GAAHPGD | |
| SCHEMBL7888441 | 0.76 | PTGER4 (0.53) | KMT2ACYP1A2CYP2C19LMNAL3MBTL1 | |
| SCHEMBL8211512 | 0.74 | ACKR3 (0.55) | KMT2ACYP1A2CYP2C19LMNAALDH1A1 | |
| SCHEMBL8207400 | 0.74 | CNR2 (0.49) | KMT2ACYP1A2CYP2C19SMN1; SMN2LMNA |
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-6143777-A | ENZYME INHIBITORS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-11-07 | — | — | US | disclosed |