Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.48 |
| ▸ | CASR | P41180 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL7558130 | 1.00 | KMT2A (0.50) | KMT2AADRB3ADRB2CYP2D6SLC6A2 | |
| SCHEMBL7558117 | 1.00 | KMT2A (0.50) | KMT2AADRB3ADRB2CYP2D6SLC6A2 | |
| SCHEMBL7560539 | 0.91 | KMT2A (0.56) | KMT2AADRB3ADRB2CYP2D6SLC6A2 | |
| SCHEMBL7560531 | 0.91 | KMT2A (0.56) | KMT2AADRB3ADRB2CYP2D6SLC6A2 | |
| SCHEMBL7560522 | 0.91 | KMT2A (0.56) | KMT2AADRB3ADRB2CYP2D6SLC6A2 | |
| SCHEMBL7559727 | 0.85 | CASR (0.69) | ADRB3ADRB2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7559732 | 0.85 | CASR (0.69) | ADRB3ADRB2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7559731 | 0.85 | CASR (0.69) | ADRB3ADRB2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7557090 | 0.85 | CASR (0.69) | ADRB3ADRB2CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7558122 | 0.82 | ALDH1A1 (0.43) | KMT2AADRB3ADRB2CYP2D6SLC6A2 |
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-2002072760-A2 | PCRA HELICASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-09-19 | — | — | WO | claimed |
| WO-2002072760-A2 | PCRA HELICASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-09-19 | — | — | WO | disclosed |