Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10551946 | 0.95 | TSHR (0.52) | TSHRACHEALDH1A1MEN1KMT2A | |
| SCHEMBL9539277 | 0.92 | ALDH1A1 (0.49) | TSHRALDH1A1MEN1KMT2ACYP1A2 | |
| SCHEMBL9538853 | 0.87 | P2RX7 (0.49) | MEN1KMT2ALMNACYP1A2CYP3A4 | |
| SCHEMBL9538362 | 0.85 | ACHE (0.48) | TSHRACHEALDH1A1MEN1KMT2A | |
| SCHEMBL10550979 | 0.85 | TSHR (0.50) | TSHRACHEALDH1A1MEN1KMT2A | |
| SCHEMBL9540587 | 0.85 | TSHR (0.50) | TSHRACHEALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9537429 | 0.85 | GAA (0.52) | TSHRALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL9540318 | 0.83 | TSHR (0.41) | TSHRALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL9540183 | 0.83 | ACHE (0.47) | TSHRACHEALDH1A1MEN1KMT2A | |
| SCHEMBL9539651 | 0.82 | ALDH1A1 (0.47) | TSHRALDH1A1KMT2ACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0151826-B1 | 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-31 | — | — | EP | claimed |