Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 5/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.33 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL27573690 | 0.90 | TLR4 (0.52) | TLR4POLBGAAKMT2ANPC1 | |
| SCHEMBL27985634 | 0.89 | TLR4 (0.56) | TLR4ALDH1A1LMNAEPHX2 | |
| SCHEMBL27985969 | 0.89 | TLR4 (0.47) | TLR4POLBGAAKMT2ANPC1 | |
| SCHEMBL872583 | 0.84 | TLR4 (0.69) | TLR4KMT2ATSHRSMN1; SMN2MRGPRX1 | |
| SCHEMBL27985962 | 0.81 | TLR4 (0.53) | TLR4POLBGAANPC1RAB9A | |
| SCHEMBL28159349 | 0.81 | TLR4 (0.58) | TLR4POLBGAANPC1RAB9A | |
| SCHEMBL27985964 | 0.81 | TLR4 (0.55) | TLR4POLBGAANPC1RAB9A | |
| SCHEMBL28159281 | 0.81 | TLR4 (0.48) | TLR4KMT2ANPC1RAB9AMEN1 | |
| SCHEMBL872918 | 0.81 | TLR4 (0.58) | TLR4POLBGAANPC1RAB9A | |
| SCHEMBL6053601 | 0.81 | TLR4 (0.52) | TLR4POLBNPC1RAB9ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102821763-B | Compound for inhibiting peripheral nerve disorder induced by anticancer agent | 武田药品工业株式会社 | 2017-09-22 | — | — | CN | disclosed |
| CN-101212986-B | Stable emulsified composition | TAKEDA PHARMACEUTICAL | 2015-01-14 | — | — | CN | disclosed |