Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16953376 | 0.82 | TSHR (0.45) | TSHRMEN1KMT2ANPC1THRB | |
| SCHEMBL16952007 | 0.82 | CYP11B1 (0.38) | MEN1KMT2AALDH1A1TDP1ALOX15 | |
| SCHEMBL16951918 | 0.82 | TSHR (0.48) | TSHRMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL16955693 | 0.81 | P2RX7 (0.37) | MEN1KMT2ANPC1ALDH1A1HPGD | |
| SCHEMBL16957085 | 0.80 | ADRB1 (0.40) | TSHRMEN1KMT2ANPC1THRB | |
| SCHEMBL16952565 | 0.79 | — | — | |
| SCHEMBL16960974 | 0.79 | SMN1; SMN2 (0.32) | MEN1KMT2ANPC1ALDH1A1HPGD | |
| SCHEMBL16951272 | 0.78 | GABRA1 (0.41) | ALDH1A1LMNAHTTKDM4E | |
| SCHEMBL16952896 | 0.77 | TSHR (0.52) | TSHRMEN1KMT2ANPC1THRB | |
| SCHEMBL16952577 | 0.77 | MEN1 (0.35) | TSHRMEN1KMT2ANPC1THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |