Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL914948 | 0.89 | KMT2A (0.39) | CHRM2CHRM1CHRM3ALDH1A1TDP1 | |
| SCHEMBL4403746 | 0.87 | CHRM2 (0.36) | CHRM2CHRM1CHRM3KMT2AMEN1 | |
| SCHEMBL4400753 | 0.85 | ALDH1A1 (0.38) | ALDH1A1TDP1TSHRHTTKDM4E | |
| Hydrochloric Acid SCHEMBL4397030 | 0.85 | DRD2 (0.35) | ALDH1A1TDP1TSHRHTTKDM4E | |
| Hydrochloric Acid SCHEMBL4405691 | 0.84 | LMNA (0.37) | ALDH1A1TDP1TSHRHTTLMNA | |
| SCHEMBL4396348 | 0.84 | SOS1 (0.34) | ALDH1A1TDP1TSHRHTTMAOA | |
| SCHEMBL4409082 | 0.84 | SRD5A2 (0.36) | CHRM2CHRM1CHRM3KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL4394242 | 0.83 | TDP1 (0.37) | ALDH1A1TDP1TSHRHTTLMNA | |
| Hydrochloric Acid SCHEMBL4406718 | 0.83 | ALDH1A1 (0.32) | ALDH1A1TDP1TSHRHTTLMNA | |
| Hydrochloric Acid SCHEMBL4406711 | 0.83 | TDP1 (0.32) | ALDH1A1TDP1TSHRHTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1720859-B1 | CHEMOKINE RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2009-12-23 | — | — | EP | claimed |