Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CD74 | P04233 | 2/20 | 0.40 |
| ▸ | MIF | P14174 | 2/20 | 0.40 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10504839 | 0.86 | IDO1 (0.42) | IDO1NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL14199346 | 0.78 | HPGD (0.44) | IDO1NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL655852 | 0.77 | HPGD (0.66) | IDO1KMOHPGDMAPK1 | |
| SCHEMBL4151771 | 0.77 | MAPK1 (0.68) | IDO1ALDH1A1MIFUSP2HPGD | |
| SCHEMBL18171842 | 0.76 | MIF (0.70) | IDO1ALDH1A1CD74MIFKMT2A | |
| SCHEMBL6408326 | 0.76 | TMEM97 (0.72) | NOS3NOS1NOS2TMEM97 | |
| SCHEMBL8568187 | 0.75 | SIGMAR1 (0.51) | IDO1NOS3NOS1NOS2TMEM97 | |
| SCHEMBL8266324 | 0.73 | MAPT (0.56) | ALDH1A1KMOHPGDTSHRKMT2A | |
| SCHEMBL399737 | 0.71 | DDB1 (0.46) | ALDH1A1HPGDTSHRMAPK1KMT2A | |
| SCHEMBL30022934 | 0.71 | DDB1 (0.46) | ALDH1A1HPGDTSHRMAPK1KMT2A |
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-1678321-A | Methods of treating or preventing autoimmune diseases with 2, 4-pyrimidinediamine compounds | RIGEL PHARMACEUTICALS INC (US) | 2005-10-05 | — | — | CN | disclosed |