Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 2/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.42 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.42 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31268519 | 0.82 | VCAM1 (0.50) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL6952380 | 0.82 | TSHR (0.61) | TDP1L3MBTL1SRD5A2ALDH1A1KMT2A | |
| SCHEMBL11069154 | 0.81 | VCAM1 (0.49) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL13537547 | 0.80 | ALDH1A1 (0.48) | ALDH1A1KMT2AMAPK13MAPK12MAPK11 | |
| SCHEMBL333237 | 0.80 | SRD5A2 (0.78) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL23873788 | 0.78 | TSHR (0.41) | VCAM1SRD5A2ALDH1A1MEN1RAB9A | |
| SCHEMBL28736779 | 0.77 | CNR2 (0.59) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL9325925 | 0.75 | VCAM1 (0.57) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL30375381 | 0.75 | CYP1A2 (0.58) | VCAM1ATMTDP1L3MBTL1SRD5A2 | |
| SCHEMBL9859728 | 0.75 | VCAM1 (0.57) | VCAM1ATMTDP1L3MBTL1SRD5A2 |
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-107033007-A | A kind of synthetic method of the chloro benzophenone of 3 nitro 4 | 陕西蒲城万德科技有限公司 | 2017-08-11 | — | — | CN | claimed |
| CN-107033007-A | A kind of synthetic method of the chloro benzophenone of 3 nitro 4 | 陕西蒲城万德科技有限公司 | 2017-08-11 | — | — | CN | disclosed |