Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | GAA | P10253 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 2/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | MAT2A | P31153 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30615622 | 0.84 | DAO (0.54) | SMN1; SMN2GAANPC1MAPTALDH1A1 | |
| SCHEMBL21464285 | 0.82 | CYP2D6 (0.48) | SMN1; SMN2NPC1HTTMAPTALDH1A1 | |
| SCHEMBL527382 | 0.81 | SMN1; SMN2 (0.56) | SMN1; SMN2GAANPC1HPGDHTT | |
| SCHEMBL527340 | 0.81 | DAO (0.54) | SMN1; SMN2HPGDMAPTALDH1A1NPSR1 | |
| SCHEMBL1699095 | 0.81 | DAO (0.62) | HPGDMAPTALDH1A1DAO | |
| SCHEMBL2256170 | 0.81 | SMN1; SMN2 (0.78) | SMN1; SMN2GAANPC1HPGDHTT | |
| SCHEMBL11554147 | 0.80 | ALDH1A1 (0.58) | HPGDALDH1A1DAOLMNAKDM4E | |
| SCHEMBL30615419 | 0.80 | NPC1 (0.42) | SMN1; SMN2GAANPC1MAT2AMAPT | |
| SCHEMBL28487985 | 0.80 | NPC1 (0.42) | SMN1; SMN2GAANPC1MAT2AMAPT | |
| SCHEMBL1699133 | 0.77 | DAO (0.58) | ALDH1A1HSP90AA1DAO |
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-2012015693-A1 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-02-02 | — | — | WO | disclosed |