Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CYP2A13 | Q16696 | 3/20 | 0.53 |
| ▸ | RORC | P51449 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL15093971 | 0.87 | CYP2A13 (0.49) | KDM4ESMN1; SMN2CYP2A13RORCALDH1A1 | |
| SCHEMBL15093889 | 0.84 | RORC (0.47) | KDM4ESMN1; SMN2CYP2A13RORCALDH1A1 | |
| SCHEMBL15265357 | 0.83 | RORC (0.48) | CYP2A13RORCALDH1A1KMT2A | |
| SCHEMBL16347215 | 0.81 | RORC (0.47) | KDM4ESMN1; SMN2CYP2A13RORCALDH1A1 | |
| SCHEMBL21292936 | 0.80 | ACVRL1 (0.47) | KDM4ERORCALDH1A1KMT2AHSD17B10 | |
| SCHEMBL1238459 | 0.80 | LGMN (0.49) | KDM4ESMN1; SMN2RORCALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL2526809 | 0.79 | LGMN (0.47) | KDM4ESMN1; SMN2RORCALDH1A1KMT2A | |
| SCHEMBL15094000 | 0.79 | RORC (0.49) | CYP2A13RORCALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL15093685 | 0.79 | RORC (0.49) | CYP2A13RORCALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL15093862 | 0.77 | MGLL (0.52) | KDM4ESMN1; SMN2RORCALDH1A1PIK3CD |
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-105517547-A | Pyrrolo-pyrrole carbamate and related organic compounds, pharmaceutical compositions, and medical uses thereof | ABIDE THERAPEUTICS | 2016-04-20 | — | — | CN | disclosed |