Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 4/20 | 0.69 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7090977 | 0.87 | VCAM1 (0.91) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL1005421 | 0.82 | VCAM1 (1.00) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL16953139 | 0.78 | VCAM1 (0.74) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| Acetonitrile SCHEMBL27788615 | 0.77 | VCAM1 (0.88) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL15517110 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1TSHRALDH1A1 | |
| SCHEMBL1344128 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL1521510 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1TSHRALDH1A1 | |
| SCHEMBL3771130 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL2303201 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1GRIN2DGRIN3B | |
| SCHEMBL6742047 | 0.74 | VCAM1 (0.74) | VCAM1XDHCYP19A1GRIN2DGRIN3B |
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-109096147-A | The room temperature curing agent containing energy and its solidified body and preparation method based on end hydroxy butadiene bonding system | 西南科技大学 | 2018-12-28 | — | — | CN | claimed |
| CN-109096147-A | The room temperature curing agent containing energy and its solidified body and preparation method based on end hydroxy butadiene bonding system | 西南科技大学 | 2018-12-28 | — | — | CN | disclosed |