Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | IAPP | P10997 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.36 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19289915 | 0.84 | AKR1B1 (0.46) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL25483123 | 0.78 | TAAR1 (0.39) | SLC22A12ALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL1352 | 0.76 | TAAR1 (0.58) | ALDH1A1KDM4EHPGDGAAMAPT | |
| SCHEMBL11875050 | 0.76 | AKR1B1 (0.67) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL4145151 | 0.74 | DYRK1A (0.41) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL16587420 | 0.74 | DYRK1A (0.41) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL3228933 | 0.74 | DYRK1A (0.41) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL16267367 | 0.74 | SMN1; SMN2 (0.47) | SLC22A12ALDH1A1AKR1B1KDM4EHPGD | |
| SCHEMBL6365366 | 0.73 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDTSHRLMNA | |
| SCHEMBL3922860 | 0.73 | MEN1 (0.42) | SLC22A12ALDH1A1KDM4EHPGDTSHR |
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-104470925-B | Imidazo-triazine formonitrile HCN as kinase inhibitor | 百时美施贵宝公司 | 2017-12-05 | — | — | CN | disclosed |