Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31470096 | 0.73 | IDO1 (0.50) | SMN1; SMN2TAAR1HTTKMT2ALMNA | |
| SCHEMBL110369 | 0.70 | AKR1B1 (0.52) | AKR1B1SMN1; SMN2TAAR1GAAGLA | |
| SCHEMBL29080438 | 0.70 | ALDH1A1 (0.42) | SMN1; SMN2TAAR1GAAHTTKMT2A | |
| SCHEMBL673238 | 0.69 | TAAR1 (0.70) | AKR1B1SMN1; SMN2TAAR1GAAGLA | |
| SCHEMBL3333154 | 0.69 | TAAR1 (0.55) | AKR1B1SMN1; SMN2TAAR1GAAGLA | |
| SCHEMBL4566260 | 0.69 | AKR1B1 (0.41) | AKR1B1SMN1; SMN2TAAR1GAAHTT | |
| SCHEMBL27977720 | 0.67 | TAAR1 (0.52) | AKR1B1SMN1; SMN2TAAR1GAAGLA | |
| SCHEMBL1007397 | 0.67 | TAAR1 (0.52) | AKR1B1SMN1; SMN2TAAR1GAAGLA | |
| SCHEMBL908383 | 0.67 | TAAR1 (0.58) | AKR1B1SMN1; SMN2TAAR1GAAADRA2A | |
| 1,2-Dichlorobenzene SCHEMBL28043924 | 0.66 | TSHR (0.71) | LMNACYP1A2CYP2A6TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |