Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.54 |
| ▸ | BCR | P11274 | 2/20 | 0.54 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.49 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.44 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3635892 | 0.86 | DYRK1A (0.53) | SCN9ARAB9AKMT2ADYRK1ACYP1A2 | |
| SCHEMBL1186835 | 0.85 | ENPP3 (0.50) | ENPP3ENPP1RAB9AMEN1KMT2A | |
| SCHEMBL16159336 | 0.82 | SCN9A (0.55) | SCN9AENPP3HDAC4CYP1A1CYP1A2 | |
| SCHEMBL14564377 | 0.82 | SCN9A (0.62) | SCN9AHDAC4 | |
| SCHEMBL8007463 | 0.80 | ESR1 (0.57) | ABL1ABCB1BCRSCN9AMEN1 | |
| SCHEMBL1180429 | 0.78 | ABL1 (0.83) | ABL1ABCB1BCRHDAC4HDAC2 | |
| SCHEMBL16159397 | 0.77 | SCN9A (0.54) | SCN9AHDAC4 | |
| SCHEMBL28428427 | 0.75 | ABL1 (0.57) | ABL1ABCB1BCRRAB9ADYRK1A | |
| SCHEMBL16159400 | 0.75 | SCN9A (0.55) | SCN9AHDAC4 | |
| SCHEMBL16159804 | 0.75 | SCN9A (0.51) | SCN9AHDAC4 |
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-2000019994-A9 | ESTROGEN RECEPTOR LIGANDS | UNIV ILLINOIS (US) | 2000-08-31 | — | — | WO | disclosed |
| WO-2000019994-A1 | ESTROGEN RECEPTOR LIGANDS | BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2000-04-13 | — | — | WO | disclosed |