Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | C1S | P09871 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16799123 | 0.77 | IDO1 (0.36) | IDO1CYP2A6SLC22A2SLC22A1SLC22A3 | |
| SCHEMBL15229084 | 0.76 | IDO1 (0.42) | IDO1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL158673 | 0.76 | ALDH1A1 (0.44) | IDO1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL3392509 | 0.76 | LMNA (0.48) | IDO1CYP2A6SLC22A2SLC22A1SLC22A3 | |
| SCHEMBL7529429 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AC1SNPC1 | |
| SCHEMBL1797820 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AC1SNPC1 | |
| SCHEMBL36862 | 0.75 | ALDH1A1 (0.58) | ALDH1A1MEN1KMT2AC1SNPC1 | |
| Hydrochloric Acid SCHEMBL5809829 | 0.74 | IDO1 (0.44) | IDO1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL6899079 | 0.74 | ALOX5 (0.41) | IDO1SLC22A2SLC22A1SLC22A3PLAU | |
| SCHEMBL3392869 | 0.74 | C1S (0.52) | IDO1ALDH1A1MAPK1C1SSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010048164-A2 | N,N'-DI-P-BROMOPHENYL GUANIDINE TREATMENT FOR STROKE AT DELAYED TIMEPOINTS | UNIVERSITY OF SOUTH FLORIDA (US) | 2010-04-29 | — | — | WO | claimed |