Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15527101 | 0.77 | ALDH1A1 (0.38) | SMN1; SMN2HPGDKDM4EALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL4345831 | 0.76 | HPGD (0.38) | SMN1; SMN2HPGDKDM4ENPC1RAB9A | |
| SCHEMBL17069012 | 0.75 | NUDT1 (0.36) | SMN1; SMN2HPGDNPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL4349754 | 0.75 | REN (0.35) | SMN1; SMN2HPGDNPC1RAB9AALDH1A1 | |
| SCHEMBL24360032 | 0.74 | DCUN1D1 (0.50) | SMN1; SMN2HPGDKDM4ENPC1RAB9A | |
| SCHEMBL29724732 | 0.74 | KDM4E (0.48) | HPGDKDM4EALDH1A1GAACYP3A4 | |
| SCHEMBL535697 | 0.74 | KDM4E (0.48) | HPGDKDM4EALDH1A1GAACYP3A4 | |
| SCHEMBL17194967 | 0.73 | NOTUM (0.35) | SMN1; SMN2HPGD | |
| SCHEMBL16481978 | 0.72 | IDO1 (0.45) | SMN1; SMN2HPGDKDM4ENPC1RAB9A | |
| SCHEMBL31429567 | 0.72 | MGAM (0.51) | SMN1; SMN2HPGDKDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2770994-A2 | 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF | Samumed, LLC (US) | 2014-09-03 | — | — | EP | disclosed |
| WO-2013166396-A2 | 1H-PYRAZOLO[3,4-B]PYRIDINES AND THERAPEUTIC USES THEREOF | SAMUMED, LLC (US) | 2013-11-07 | — | — | WO | disclosed |