Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 10/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.41 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28604283 | 1.00 | CASP1 (0.42) | CASP1CTRB1ELANEP2RX4P2RX1 | |
| SCHEMBL27758260 | 0.73 | PDE4A (0.44) | SMN1; SMN2NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1398957 | 0.73 | CTRB1 (0.45) | CTRB1P2RX4P2RX1P2RX3HTR2C | |
| SCHEMBL27963796 | 0.72 | — | — | |
| SCHEMBL6951477 | 0.72 | — | — | |
| SCHEMBL6218712 | 0.72 | PTGDR2 (0.42) | ELANEMEN1KMT2A | |
| SCHEMBL1399082 | 0.71 | CTRB1 (0.43) | CTRB1P2RX4P2RX1P2RX3HTR2C | |
| SCHEMBL9129570 | 0.70 | SMN1; SMN2 (0.47) | SMN1; SMN2NPC1GAARAB9ACYP2C19 | |
| SCHEMBL18204379 | 0.70 | MEN1 (0.46) | HTR2CSMN1; SMN2NPC1RAB9ACYP2C19 | |
| SCHEMBL10702265 | 0.70 | MEN1 (0.52) | CTRB1P2RX4P2RX1P2RX3SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112512589-A | Dimeric immunomodulatory compounds against CEREBLON-based mechanisms | H·李·莫菲特癌症中心研究有限公司 | 2021-03-16 | — | — | CN | disclosed |