Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 2/20 | 0.48 |
| ▸ | ACE | P12821 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ECE1 | P42892 | 1/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MDM4 | O15151 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL31139218 | 0.82 | ACE (0.63) | CTSCACELMNAECE1ITGB3 | |
| Trifluoroacetic Acid SCHEMBL28569723 | 0.82 | ACE (0.63) | CTSCACELMNAECE1ITGB3 | |
| SCHEMBL28771144 | 0.82 | TACR1 (0.57) | MEN1ALDH1A1LMNAKMT2AITGB3 | |
| SCHEMBL4432681 | 0.81 | ATM (0.63) | MEN1ALDH1A1LMNAKMT2APOLB | |
| SCHEMBL4432687 | 0.81 | ATM (0.63) | MEN1ALDH1A1LMNAKMT2APOLB | |
| SCHEMBL12234918 | 0.81 | CTSC (0.55) | CTSCACEMEN1ALDH1A1LMNA | |
| SCHEMBL28769015 | 0.80 | GPR139 (0.38) | CTSCACEALDH1A1LMNAKMT2A | |
| SCHEMBL18429658 | 0.80 | ACE (0.62) | CTSCACEITGB3ITGA2BPOLB | |
| SCHEMBL18515876 | 0.80 | ACE (0.62) | CTSCACEITGB3ITGA2BPOLB | |
| SCHEMBL30516239 | 0.80 | ACE (0.62) | CTSCACEITGB3ITGA2BPOLB |
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-112888689-A | Photochromic and electrochromic compounds | 格拉斯哥大学理事会 | 2021-06-01 | — | — | CN | disclosed |