Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | KHK | P50053 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PTGIR | P43119 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL18421862 | 0.87 | SLC6A2 (0.45) | TSHRTAAR1ACHESLC6A2SLC6A4 | |
| SCHEMBL30171515 | 0.78 | SLC6A2 (0.40) | TAAR1ACHESLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3652923 | 0.78 | TSHR (0.46) | TSHRTAAR1ACHECNR2KHK | |
| SCHEMBL3652921 | 0.78 | TSHR (0.46) | TSHRTAAR1ACHECNR2KHK | |
| SCHEMBL21534662 | 0.78 | ACHE (0.53) | TSHRTAAR1ACHEKHK | |
| Diethylaniline SCHEMBL17594 | 0.78 | TSHR (0.70) | TSHRTAAR1CNR2MEN1NPC1 | |
| Diethylaniline SCHEMBL9000098 | 0.78 | TSHR (0.70) | TSHRTAAR1CNR2MEN1NPC1 | |
| SCHEMBL1060074 | 0.77 | TAAR1 (0.55) | TSHRTAAR1ACHECNR2MEN1 | |
| SCHEMBL13399056 | 0.76 | LMNA (0.47) | TAAR1SLC6A2SLC6A4SLC6A3MEN1 | |
| Diethylaniline SCHEMBL1920410 | 0.75 | TSHR (0.67) | TSHRTAAR1CNR2MEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1417190-A1 | SUBSTITUTED PIPERAZINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR | Amgen Inc. (US) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003009850-A1 | SUBSTITUTED PIPERAZINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR | AMGEN INC. (US) | 2003-02-06 | — | — | WO | disclosed |