Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11508215 | 0.85 | ALDH1A1 (0.36) | TSHRSIGMAR1ALDH1A1LMNACYP3A4 | |
| SCHEMBL18190894 | 0.81 | TSHR (0.43) | TSHRACHESIGMAR1ALDH1A1LMNA | |
| SCHEMBL11871489 | 0.79 | TSHR (0.44) | TSHRACHESIGMAR1MEN1KMT2A | |
| SCHEMBL7129369 | 0.77 | TSHR (0.39) | TSHRACHESIGMAR1ALDH1A1LMNA | |
| SCHEMBL2093822 | 0.77 | TSHR (0.39) | TSHRACHESIGMAR1ALDH1A1LMNA | |
| SCHEMBL9396470 | 0.76 | CHEK1 (0.41) | TSHRMEN1KMT2AALDH1A1LMNA | |
| Water SCHEMBL27875928 | 0.75 | TSHR (0.47) | TSHRACHESIGMAR1ALDH1A1LMNA | |
| SCHEMBL11656389 | 0.74 | TSHR (0.39) | TSHRACHEMEN1KMT2AALDH1A1 | |
| SCHEMBL13159016 | 0.74 | CYP3A4 (0.40) | MEN1KMT2AALDH1A1NPSR1CYP3A4 | |
| SCHEMBL1344357 | 0.73 | KMT2A (0.42) | TSHRMEN1KMT2AALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6177459-B1 | WELL TOLERATED BY PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 2001-01-23 | — | — | US | disclosed |
| EP-0809632-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THEIR USE AS FUNGICIDES | BAYER AG (DE) | 1997-12-03 | — | — | EP | disclosed |
| WO-1996025398-A1 | SUBSTITUTED HETEROCYCLIC COMPOUNDS AND THEIR USE AS FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1996-08-22 | — | — | WO | disclosed |