Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5966724 | 0.83 | ACHE (0.48) | CYP19A1ACHEAOC3ALDH1A1SMN1; SMN2 | |
| SCHEMBL19788684 | 0.82 | ACHE (0.47) | CYP19A1ACHEAOC3ALDH1A1SMN1; SMN2 | |
| SCHEMBL4426149 | 0.81 | MAT2A (0.44) | AOC3ALDH1A1SMN1; SMN2KDM4ECARM1 | |
| SCHEMBL3408332 | 0.79 | AOC3 (0.44) | CYP19A1ACHEAOC3ALDH1A1SMN1; SMN2 | |
| SCHEMBL21636847 | 0.77 | MAPT (0.44) | AOC3ALDH1A1SMN1; SMN2KDM4ECARM1 | |
| SCHEMBL6823718 | 0.77 | NTRK1 (0.40) | AOC3ALDH1A1SMN1; SMN2KDM4ETSHR | |
| SCHEMBL11108577 | 0.77 | ACHE (0.49) | CYP19A1ACHEALDH1A1KDM4EMAPT | |
| SCHEMBL3423087 | 0.75 | CRHBP (0.57) | CYP19A1ALDH1A1MAPTLMNA | |
| SCHEMBL17774571 | 0.75 | ACHE (0.50) | CYP19A1ACHEALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL3424749 | 0.75 | GAA (0.44) | ALDH1A1SMN1; SMN2KDM4ETSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7718671-B2 | Substituted arylthiourea derivatives useful as inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2010-05-18 | — | — | US | disclosed |
| US-7718671-B2 | Substituted arylthiourea derivatives useful as inhibitors of viral replication | ACHILLION PHARMACEUTICALS, INC. (US) | 2010-05-18 | — | — | US | disclosed |