Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13962145 | 0.86 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2HPGDKMT2ATP53 | |
| SCHEMBL13341114 | 0.84 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2HPGDKMT2ATP53 | |
| SCHEMBL13202892 | 0.84 | ALDH1A1 (0.76) | ALDH1A1SMN1; SMN2HPGDKMT2APOLB | |
| SCHEMBL15724692 | 0.82 | HPGD (0.52) | ALDH1A1SMN1; SMN2HPGDKMT2ATP53 | |
| SCHEMBL7437345 | 0.79 | RAB9A (0.50) | ALDH1A1SMN1; SMN2HPGDMAPTPOLB | |
| SCHEMBL2054548 | 0.78 | RAB9A (0.49) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| SCHEMBL16601605 | 0.78 | RAB9A (0.49) | ALDH1A1SMN1; SMN2HPGDKMT2AMAPT | |
| SCHEMBL1519184 | 0.78 | RAB9A (0.49) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| SCHEMBL1107089 | 0.78 | RAB9A (0.49) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| SCHEMBL9259044 | 0.75 | KMT2A (0.61) | ALDH1A1SMN1; SMN2HPGDKMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-8993585-B2 | Cyclic amine substituted pyrimidinediamines as PKC inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2015-03-31 | — | — | US | disclosed |