Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 5/20 | 0.43 |
| ▸ | BCHE | P06276 | 4/20 | 0.43 |
| ▸ | BACE1 | P56817 | 4/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.41 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4597890 | 0.88 | CXCR3 (0.39) | ACHECHRM2CHRM3 | |
| SCHEMBL4596620 | 0.84 | NPSR1 (0.38) | ALDH1A1SMN1; SMN2CHRM2CHRM3 | |
| SCHEMBL4597759 | 0.71 | KCNJ1 (0.51) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL445885 | 0.66 | ALDH1A1 (0.97) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL25176332 | 0.66 | KCNJ1 (0.62) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL16370438 | 0.65 | ALDH1A1 (0.94) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL14726057 | 0.65 | ALDH1A1 (1.00) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL3151578 | 0.65 | OPRL1 (0.69) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL5626457 | 0.65 | ALDH1A1 (0.74) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL3157794 | 0.65 | TRPV6 (0.77) | KCNJ1ALDH1A1LMNAMAPTSMN1; SMN2 |
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-1924265-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | Genzyme Corporation (US) | 2008-05-28 | — | — | EP | disclosed |
| WO-2007022371-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | GENZYME CORPORATION (US) | 2007-02-22 | — | — | WO | disclosed |