Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | ACLY | P53396 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7530805 | 0.88 | CYP2C9 (0.50) | CYP2C9ALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL7534382 | 0.86 | CYP2C9 (0.55) | CYP2C9ALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL7530810 | 0.83 | ALDH1A1 (0.58) | CYP2C9ALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL532885 | 0.79 | LMNA (0.78) | CYP2C9ALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL7537977 | 0.79 | ACLY (0.52) | ALDH1A1TSHRNPSR1HPGDLMNA | |
| SCHEMBL7531860 | 0.79 | LMNA (0.54) | ALDH1A1TSHRHPGDLMNAACLY | |
| SCHEMBL532975 | 0.79 | ACLY (0.69) | ALDH1A1TSHRNPSR1HPGDLMNA | |
| SCHEMBL17331324 | 0.78 | CYP2C9 (0.80) | CYP2C9ALDH1A1TSHRNPSR1HPGD | |
| Hydrochloric Acid SCHEMBL533067 | 0.78 | ACLY (0.68) | ALDH1A1TSHRNPSR1HPGDLMNA | |
| SCHEMBL7531722 | 0.77 | LMNA (0.55) | ALDH1A1TSHRHPGDLMNAACLY |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002028353-A2 | PHOSPHATE TRANSPORT INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2002-04-11 | — | — | WO | disclosed |