Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | ERCC5 | P28715 | 2/20 | 0.49 |
| ▸ | FEN1 | P39748 | 2/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.49 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.49 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.49 |
| ▸ | F2R | P25116 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL15066482 | 0.83 | ALDH1A1 (0.52) | TSHRERCC5FEN1ALDH1A1TP53 | |
| SCHEMBL16953277 | 0.82 | ALDH1A1 (0.38) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL16956594 | 0.79 | TSHR (0.50) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL16956641 | 0.78 | TSHR (0.64) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL24070109 | 0.78 | TSHR (0.48) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL2255346 | 0.78 | ERCC5 (0.61) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL30209733 | 0.78 | TSHR (0.48) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL5543077 | 0.75 | TSHR (0.50) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL2094929 | 0.74 | TSHR (0.59) | TSHRERCC5FEN1TAS1R3TAS1R1 | |
| SCHEMBL10706917 | 0.73 | TSHR (0.58) | TSHRERCC5FEN1TAS1R3TAS1R1 |
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 |