Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL2474639 | 0.86 | ALDH1A1 (0.33) | ALDH1A1TSHRCYP2D6HTTHTR2A | |
| SCHEMBL31561750 | 0.80 | LMNA (0.31) | — | |
| SCHEMBL4964190 | 0.79 | OPRM1 (0.38) | ALDH1A1TSHRHTTHTR2A | |
| SCHEMBL4961724 | 0.76 | PDK2 (0.39) | ALDH1A1TSHRHTTHTR2A | |
| SCHEMBL3203338 | 0.72 | HTR2A (0.35) | ALDH1A1TSHRHTR2A | |
| SCHEMBL4963145 | 0.71 | TSHR (0.46) | TDP1ALDH1A1TSHRHTT | |
| SCHEMBL12681587 | 0.70 | TSHR (0.38) | TDP1ALDH1A1TSHRHTT | |
| SCHEMBL3203818 | 0.68 | TSHR (0.33) | ALDH1A1TSHRHTR2A | |
| SCHEMBL4482310 | 0.68 | HCAR2 (0.38) | ALDH1A1TSHR | |
| SCHEMBL31561698 | 0.68 | TSHR (0.33) | ALDH1A1TSHRHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101941964-A | Has the Chemokine Receptors bonded heterogeneous ring compound that promotes effect | ANORMED INC | 2011-01-12 | — | — | CN | disclosed |