Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 5/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | APLNR | P35414 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16097833 | 0.86 | GABRA1 (0.42) | GABRA1GABRB2TSHRARCA1 | |
| SCHEMBL7790350 | 0.83 | GABRA1 (0.41) | GABRA1GABRB2TSHRARCA1 | |
| SCHEMBL27367558 | 0.77 | DYRK1A (0.40) | TSHRCA1CA2 | |
| SCHEMBL25843243 | 0.76 | AR (0.35) | TSHRARALDH1A1 | |
| SCHEMBL22447106 | 0.75 | TSHR (0.36) | GABRA1GABRB2TSHRARCYP2C9 | |
| SCHEMBL16771350 | 0.75 | TSHR (0.46) | TSHRCA1CA2ALDH1A1CYP2C9 | |
| SCHEMBL8763180 | 0.74 | GABRA1 (0.40) | GABRA1GABRB2TSHRARCA1 | |
| SCHEMBL5728797 | 0.74 | CYP19A1 (0.43) | TSHRNPSR1ALDH1A1FFAR1 | |
| SCHEMBL30252315 | 0.74 | CYP19A1 (0.43) | TSHRNPSR1ALDH1A1FFAR1 | |
| SCHEMBL106062 | 0.73 | TSHR (0.50) | GABRA1GABRB2TSHRARCA1 |
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-105051044-A | Compounds and their use for modulating hemoglobin | GLOBAL BLOOD THERAPEUTICS INC | 2015-11-11 | — | — | CN | disclosed |