Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.46 |
| ▸ | RELA | Q04206 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | SYK | P43405 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL657038 | 1.00 | ELANE (0.48) | ELANERAB9ANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27612449 | 0.94 | ELANE (0.44) | ELANERAB9ANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL17417261 | 0.94 | RAB9A (0.48) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL30431564 | 0.86 | RAB9A (0.47) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL27612355 | 0.83 | SYK (0.47) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL655671 | 0.83 | SYK (0.47) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL27612649 | 0.83 | RAB9A (0.54) | ELANERAB9ANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL653156 | 0.83 | RAB9A (0.54) | ELANERAB9ANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL30430694 | 0.81 | ALDH1A1 (0.64) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL34462345 | 0.81 | NPSR1 (0.65) | RAB9ANPSR1ALDH1A1SMN1; SMN2TSHR |
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 |