Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.82 |
| ▸ | CNR2 | P34972 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.58 |
| ▸ | RELA | Q04206 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL335075 | 0.93 | MGAM (0.68) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| SCHEMBL30835890 | 0.93 | MGAM (0.68) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Hydrochloric Acid SCHEMBL9524735 | 0.91 | MGAM (0.66) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL1242670 | 0.91 | MGAM (1.00) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL29350584 | 0.91 | MGAM (1.00) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL39024 | 0.91 | MGAM (1.00) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL4588314 | 0.89 | MGAM (0.96) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL5228655 | 0.89 | MGAM (0.96) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL8798794 | 0.89 | MGAM (0.96) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 | |
| Quinaldic Acid SCHEMBL4802724 | 0.89 | MGAM (0.96) | MGAMCNR2SMN1; SMN2RAB9ANFKB1 |
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-2005113522-A1 | AZOLE CARBOXAMIDE INHIBITORS OF BACTERIAL TYPE III PROTEIN SECRETION SYSTEMS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2005-12-01 | — | — | WO | disclosed |
| WO-2005018541-A2 | COX-2 INHIBITOR AND SEROTONIN MODULATOR FOR TREATING CNS DAMAGE | PHARMACIA CORPORATION (US) | 2005-03-03 | — | — | WO | disclosed |