Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 15/20 | 0.62 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.54 |
| ▸ | MTOR | P42345 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11174404 | 0.84 | ADRB2 (0.61) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| Hydrochloric Acid SCHEMBL4387242 | 0.84 | MAPT (0.74) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL13754643 | 0.83 | ADRB2 (0.72) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL7143881 | 0.83 | ADRB2 (0.72) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL7143882 | 0.83 | ADRB2 (0.72) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL27955362 | 0.82 | ADRB2 (0.57) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL19236388 | 0.81 | ADRB2 (0.62) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL14291852 | 0.81 | ADRB2 (0.62) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL15677514 | 0.81 | ADRB2 (0.73) | ADRB2ADRB1TSHRCYP1A2NFKB1 | |
| SCHEMBL9661334 | 0.81 | ADRB2 (0.69) | ADRB2ADRB1TSHRCYP1A2NFKB1 |
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-2023127814-A1 | SUBSTITUTED QUINOLINE DERIVATIVE | ASTELLAS PHARMA INC. (JP) | 2023-07-06 | — | — | WO | disclosed |