Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 4/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28738819 | 0.90 | NOS2 (0.48) | NOS2MRGPRX4KDM4EVCAM1CYP2D6 | |
| SCHEMBL6175873 | 0.83 | MAOB (0.47) | NOS2MRGPRX4KDM4EVCAM1MAOA | |
| SCHEMBL27336403 | 0.81 | PTGDR2 (0.40) | MRGPRX4KDM4EPTGDR2ALDH1A1USP2 | |
| SCHEMBL28738821 | 0.80 | AAK1 (0.42) | KDM4EMAOAMAOBXDHPTGDR2 | |
| SCHEMBL28305946 | 0.80 | FFAR1 (0.43) | KDM4EMAOAMAOBXDHALDH1A1 | |
| SCHEMBL1853203 | 0.80 | PTGDR2 (0.51) | NOS2MRGPRX4PTGDR2MAPT | |
| SCHEMBL8799276 | 0.79 | NOS2 (0.43) | NOS2MRGPRX4KDM4EVCAM1CYP2D6 | |
| SCHEMBL29728508 | 0.78 | KMT2A (0.42) | KDM4EALDH1A1HPGDMEN1MAPT | |
| SCHEMBL8861735 | 0.77 | KMT2A (0.57) | MRGPRX4SLC6A2SLC6A4ALDH1A1HPGD | |
| SCHEMBL31441456 | 0.75 | MAOA (0.61) | NOS2MRGPRX4KDM4EVCAM1CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380718-B | Acylation method of aniline compound | 河南农业大学 | 2022-09-30 | — | — | CN | disclosed |
| CN-114380718-A | Acylation method of aniline compound | 河南农业大学 | 2022-04-22 | — | — | CN | disclosed |
| US-8481569-B2 | Iminopyridine derivatives and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-07-09 | — | — | US | disclosed |
| WO-2009131245-A1 | IMINOPYRIDINE DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-10-29 | — | — | WO | disclosed |