Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL18728495 | 1.00 | MRGPRX4 (0.46) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL30272015 | 0.87 | MRGPRX4 (0.47) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL30272016 | 0.87 | MRGPRX4 (0.47) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL18728740 | 0.87 | MRGPRX4 (0.47) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL28912849 | 0.85 | MRGPRX4 (0.49) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL18727941 | 0.84 | HTR1B (0.50) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL28912859 | 0.83 | MRGPRX4 (0.47) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL4729087 | 0.83 | ALDH1A1 (0.57) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL18704479 | 0.81 | MRGPRX4 (0.46) | MRGPRX4RAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL29982369 | 0.80 | HTR7 (0.58) | RAB9ANPC1SMN1; SMN2CYP1A2CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111225896-B | Immunomodulatory compounds | 凯莫森特里克斯股份有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-117561246-A | Novel biphenyl derivative, preparation method and medical application thereof | 西安新通药物研究股份有限公司 | 2024-02-13 | — | — | CN | disclosed |
| CN-113461668-B | Novel biphenyl derivative, preparation method and medical application thereof | 西安新通药物研究股份有限公司 | 2022-12-09 | — | — | CN | disclosed |
| CN-114761085-A | Compounds useful as immunomodulators | 百时美施贵宝公司 | 2022-07-15 | — | — | CN | disclosed |