Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.45 |
| ▸ | NPY2R | P49146 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 9/20 | 0.40 |
| ▸ | RAB9A | P51151 | 7/20 | 0.40 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 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 | |
|---|---|---|---|---|
| SCHEMBL5869315 | 0.86 | NOTUM (0.45) | HPGDMAPTSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL5869308 | 0.86 | NOTUM (0.45) | HPGDMAPTSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL7419194 | 0.84 | NPC1 (0.50) | HPGDMAPTSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL7421354 | 0.84 | NOTUM (0.46) | HPGDMAPTSMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL7383798 | 0.78 | BMP1 (0.35) | ALDH1A1NPC1RAB9A | |
| SCHEMBL7423907 | 0.75 | SHMT1 (0.56) | HPGDMAPTSMN1; SMN2CYP2C9NPC1 | |
| SCHEMBL5869392 | 0.74 | HPGD (0.50) | HPGDMAPTNPY1RNPY2RSMN1; SMN2 | |
| SCHEMBL8248427 | 0.74 | HPGD (0.50) | HPGDMAPTNPY1RNPY2RSMN1; SMN2 | |
| SCHEMBL7378945 | 0.72 | MEN1 (0.48) | HPGDNPC1RAB9AMEN1KMT2A | |
| SCHEMBL1655299 | 0.72 | ATM (0.46) | HPGDMAPTSMN1; SMN2ALDH1A1NPC1 |
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-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | claimed |
| WO-2002039997-A2 | ACE-2 MODULATING COMPOUNDS AND USE THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2002-05-23 | — | — | WO | disclosed |