Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11680975 | 0.86 | MAPT (0.59) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL28629877 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL27228526 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL17373905 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL616791 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL31717179 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL30163112 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL1024276 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL2571492 | 0.80 | NOS1 (0.53) | NOS1MAPTCYP3A4LMNAALOX15 | |
| SCHEMBL1026662 | 0.78 | NOS1 (0.54) | NOS1MAPTCYP3A4LMNAALOX15 |
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-105636586-A | ERK inhibitors and methods of use | ARAXES PHARMA LLC | 2016-06-01 | — | — | CN | disclosed |