Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6590290 | 1.00 | KDM4E (0.36) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 | |
| SCHEMBL4761879 | 0.94 | MMP2 (0.37) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 | |
| SCHEMBL4763065 | 0.94 | MMP2 (0.37) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 | |
| SCHEMBL4767072 | 0.93 | TAS1R3 (0.38) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 | |
| SCHEMBL4767079 | 0.93 | TAS1R3 (0.38) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 | |
| SCHEMBL6590536 | 0.92 | TAS1R3 (0.38) | TAS1R3TAS1R1CTSK | |
| SCHEMBL6590533 | 0.92 | TAS1R3 (0.38) | TAS1R3TAS1R1CTSK | |
| SCHEMBL4768953 | 0.89 | CTSK (0.45) | ALDH1A1RAB9ATAS1R3TAS1R1CTSK | |
| SCHEMBL4768959 | 0.89 | CTSK (0.45) | ALDH1A1RAB9ATAS1R3TAS1R1CTSK | |
| SCHEMBL4765077 | 0.88 | ALDH1A1 (0.37) | KDM4EALDH1A1RAB9ASMN1; SMN2CHRNA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1307204-A4 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORP (US) | 2004-06-02 | — | — | EP | disclosed |
| EP-1307204-A1 | PROTEASE INHIBITORS | SmithKline Beecham Corporation (US) | 2003-05-07 | — | — | EP | disclosed |
| WO-2001095911-A1 | PROTEASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-12-20 | — | — | WO | disclosed |