Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | RXRB | P28702 | 1/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 7/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | RGS12 | O14924 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1244833 | 0.85 | RXRA (0.41) | RXRARXRBRXRGNR3C1THRB | |
| SCHEMBL8512 | 0.82 | AKR1B1 (0.48) | RXRARXRBRXRGNR3C1THRB | |
| SCHEMBL27809833 | 0.81 | THRB (0.41) | THRBAKR1B1TDP1HPGDHSD17B10 | |
| SCHEMBL27885966 | 0.81 | THRB (0.38) | THRBAKR1B1TDP1HPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL3297493 | 0.80 | AKR1B1 (0.46) | RXRARXRBRXRGNR3C1THRB | |
| SCHEMBL1401565 | 0.79 | CYP4F2 (0.49) | RXRARXRBRXRGNR3C1THRB | |
| SCHEMBL16050465 | 0.77 | GPR84 (0.62) | THRBHPGDHSD17B10THRAALDH1A1 | |
| SCHEMBL3127720 | 0.77 | IDO1 (0.42) | TDP1 | |
| SCHEMBL1560270 | 0.77 | AKR1B1 (0.49) | RXRARXRBRXRGNR3C1THRB | |
| SCHEMBL10241639 | 0.77 | THRB (0.43) | RXRARXRBRXRGNR3C1THRB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102625808-B | Spirocyclic amide derivatives | ASTRAZENECA AB | 2014-08-27 | — | — | CN | disclosed |
| CN-102625808-A | Spirocyclic amide derivatives | ASTRAZENECA AB | 2012-08-01 | — | — | CN | disclosed |
| CN-102083839-A | Compound (I) | ASTRAZENECA AB | 2011-06-01 | — | — | CN | disclosed |