Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.48 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | STAT1 | P42224 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7101804 | 0.77 | CYP1A2 (0.64) | CYP1A2CYP2C19MAPTACHEALDH1A1 | |
| SCHEMBL5043916 | 0.76 | TGM2 (0.63) | CYP1A2CYP2C19TRPV1HDAC1MAPT | |
| SCHEMBL17693070 | 0.74 | MAPT (0.81) | CYP1A2TRPV1HDAC1MAPTTP53 | |
| SCHEMBL7615793 | 0.74 | ACHE (0.56) | TRPV1HDAC1ACHEIMPDH2IMPDH1 | |
| SCHEMBL9865053 | 0.72 | ALDH1A1 (0.70) | CYP1A2CYP2C19TP53IMPDH2IMPDH1 | |
| Acetone SCHEMBL28054480 | 0.71 | AR (0.57) | CYP1A2CYP2C19MAPTALDH1A1MEN1 | |
| SCHEMBL10405241 | 0.71 | TRPV1 (0.60) | CYP1A2CYP2C19TRPV1HDAC1MAPT | |
| SCHEMBL27783467 | 0.71 | CYP1A2 (0.55) | CYP1A2CYP2C19TRPV1HDAC1MAPT | |
| SCHEMBL11348284 | 0.71 | CYP1A2 (0.62) | CYP1A2CYP2C19HDAC1MAPTTP53 | |
| SCHEMBL8345734 | 0.70 | KMT2A (0.78) | CYP1A2CYP2C19HDAC1MAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003101941-A2 | ALPHA ACYLOXYACETAMIDES FOR KALLIKREIN AND UROKINASE INHIBITION | GENZYME CORPORATION (US) | 2003-12-11 | — | — | WO | disclosed |