Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9715024 | 1.00 | TSHR (0.44) | TSHRHCAR2ALDH1A1HPGDGSTP1 | |
| SCHEMBL27650752 | 0.89 | TSHR (0.56) | TSHRALDH1A1HPGDGSTP1 | |
| SCHEMBL182262 | 0.85 | TSHR (0.59) | TSHRHCAR2ALDH1A1HPGDGSTP1 | |
| SCHEMBL1532470 | 0.85 | TSHR (0.59) | TSHRHCAR2ALDH1A1HPGDGSTP1 | |
| SCHEMBL182261 | 0.85 | TSHR (0.59) | TSHRHCAR2ALDH1A1HPGDGSTP1 | |
| SCHEMBL7902118 | 0.83 | TSHR (0.37) | TSHRALDH1A1HPGDGSTP1 | |
| SCHEMBL7902121 | 0.83 | TSHR (0.37) | TSHRALDH1A1HPGDGSTP1 | |
| SCHEMBL30100815 | 0.82 | HCAR2 (0.59) | TSHRHCAR2ALDH1A1HPGDATM | |
| SCHEMBL30268 | 0.82 | HCAR2 (0.59) | TSHRHCAR2ALDH1A1HPGDATM | |
| SCHEMBL18418525 | 0.82 | HCAR2 (0.50) | TSHRHCAR2ALDH1A1HPGDATM |
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-10793807-B2 | Organoleptic compounds | INTERNATIONAL FLAVORS & FRAGRANCES INC (US) | 2020-10-06 | — | — | US | disclosed |
| WO-2020018737-A1 | NOVEL ORGANOLEPTIC COMPOUNDS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2020-01-23 | — | — | WO | disclosed |