Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 3/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8876991 | 0.83 | MAPT (0.37) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8806120 | 0.83 | CYP2D6 (0.36) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8804858 | 0.82 | CYP2D6 (0.36) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8877427 | 0.81 | MAPT (0.40) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8804868 | 0.81 | CYP2D6 (0.35) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL9142589 | 0.81 | CYP2D6 (0.35) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8805236 | 0.80 | ACHE (0.58) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8804087 | 0.80 | TSHR (0.35) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| Hydrochloric Acid SCHEMBL8804162 | 0.79 | ACHE (0.57) | TSHRCYP2D6MAPTHTR1AHTR2C | |
| SCHEMBL8878777 | 0.78 | MAPT (0.35) | TSHRCYP2D6MAPTHTR1AHTR2C |
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-5616705-A | N-substituted azabicycloheptane derivatives, their preparation and use | BASF AKTIENGESELLSCHAFT (DE) | 1997-04-01 | — | — | US | disclosed |