Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16956438 | 0.85 | MAPT (0.49) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16950758 | 0.85 | CYP19A1 (0.48) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16956994 | 0.84 | SMN1; SMN2 (0.57) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16956126 | 0.82 | MEN1 (0.44) | TDP1HTTLMNASMN1; SMN2MEN1 | |
| SCHEMBL16952799 | 0.81 | AKR1C3 (0.40) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL2962266 | 0.81 | SMN1; SMN2 (0.60) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16952989 | 0.80 | ALDH1A1 (0.55) | TDP1HTTLMNASMN1; SMN2PKM | |
| SCHEMBL17374954 | 0.80 | TDP1 (0.58) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16959328 | 0.79 | TDP1 (0.51) | TDP1HTTLMNASMN1; SMN2PTGS2 | |
| SCHEMBL16956291 | 0.79 | TDP1 (0.51) | TDP1HTTLMNASMN1; SMN2PTGS2 |
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 |