Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.49 |
| ▸ | HRH2 | P25021 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14417369 | 0.89 | TSHR (0.63) | TSHRMEP1BMAPK1 | |
| SCHEMBL108372 | 0.89 | TAAR1 (0.58) | TSHRTAAR1SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL14376648 | 0.85 | TSHR (0.56) | TSHRMAPT | |
| SCHEMBL16312618 | 0.81 | HRH2 (0.55) | TAAR1SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL11693746 | 0.81 | HRH2 (0.55) | TAAR1SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL12124858 | 0.80 | HRH3 (0.43) | TSHR | |
| SCHEMBL1740556 | 0.79 | HDAC1 (0.59) | TSHRTAAR1SLC6A4CYP3A4CYP1A2 | |
| SCHEMBL92784 | 0.79 | TAAR1 (0.60) | TAAR1SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL189831 | 0.79 | TAAR1 (0.60) | TAAR1SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL2601968 | 0.79 | HRH2 (0.52) | TSHRTAAR1SLC6A4SLC6A2SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5807754-A | Combinatorial synthesis and high-throughput screening of a Rev-inhibiting arylidenediamide array | ARQULE, INC. (US) | 1998-09-15 | — | — | US | claimed |
| US-5807754-A | Combinatorial synthesis and high-throughput screening of a Rev-inhibiting arylidenediamide array | ARQULE, INC. (US) | 1998-09-15 | — | — | US | disclosed |