Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL9720249 | 0.83 | TDP1 (0.60) | TDP1L3MBTL1HRH1LMNACYP2A6 | |
| SCHEMBL10061567 | 0.77 | L3MBTL1 (0.75) | TDP1L3MBTL1HRH1CYP2A6CYP3A4 | |
| SCHEMBL2098501 | 0.76 | TDP1 (0.55) | TDP1L3MBTL1HRH1CYP2A6TBXAS1 | |
| SCHEMBL23015074 | 0.76 | TDP1 (0.68) | TDP1L3MBTL1HRH1CYP2A6TRPV1 | |
| SCHEMBL2608878 | 0.76 | TDP1 (0.54) | TDP1L3MBTL1HRH1CYP2A6CYP3A4 | |
| SCHEMBL10385452 | 0.75 | MEN1 (0.54) | LMNACYP3A4MAPTSMN1; SMN2PLA2G2A | |
| SCHEMBL9720214 | 0.75 | MEN1 (0.54) | LMNACYP3A4MAPTSMN1; SMN2PLA2G2A | |
| SCHEMBL25380936 | 0.75 | TDP1 (0.96) | TDP1L3MBTL1HRH1CYP2A6TRPV1 | |
| SCHEMBL6114843 | 0.75 | TDP1 (0.96) | TDP1L3MBTL1HRH1CYP2A6TRPV1 | |
| SCHEMBL25381701 | 0.75 | TDP1 (0.96) | TDP1L3MBTL1HRH1CYP2A6TRPV1 |
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-5081245-A | Selective antitumor agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-01-14 | — | — | US | disclosed |
| EP-0356765-A2 | Carboxylic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-03-07 | — | — | EP | disclosed |