Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1593804 | 0.81 | ALDH1A1 (0.62) | ALDH1A1CYP1A2MAPTRAB9ANPC1 | |
| SCHEMBL5306702 | 0.79 | ALDH1A1 (0.49) | ALDH1A1MAPTRAB9AHPGDKMT2A | |
| SCHEMBL5310013 | 0.72 | HDAC3 (0.43) | ALDH1A1CYP1A2CYP2C19MAPTRAB9A | |
| SCHEMBL1595751 | 0.72 | HPGD (0.53) | ALDH1A1CYP1A2CYP2C19MAPTRAB9A | |
| SCHEMBL1593440 | 0.72 | ALDH1A1 (0.59) | ALDH1A1NPC1SMN1; SMN2GAA | |
| SCHEMBL325284 | 0.72 | ALDH1A1 (0.68) | ALDH1A1CYP1A2CYP2C19MAPTRAB9A | |
| SCHEMBL325285 | 0.72 | ALDH1A1 (0.68) | ALDH1A1CYP1A2CYP2C19MAPTRAB9A | |
| SCHEMBL1594334 | 0.71 | ALDH1A1 (0.42) | ALDH1A1MAPTKMT2AMEN1POLB | |
| SCHEMBL21611649 | 0.71 | NPC1 (0.55) | ALDH1A1MAPTRAB9AKMT2ANPC1 | |
| SCHEMBL23251385 | 0.71 | MAPT (0.81) | ALDH1A1CYP1A2CYP2C19MAPTRAB9A |
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-2007034279-A2 | C3A ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREOF | PFIZER PRODUCTS INC. (US) | 2007-03-29 | — | — | WO | disclosed |