Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.34 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.34 |
| ▸ | ITGAL | P20701 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CRHBP | P24387 | 2/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL372145 | 0.91 | ITGB2 (0.39) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL3136613 | 0.87 | ITGB2 (0.39) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL20351197 | 0.86 | ITGB2 (0.38) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL13243539 | 0.86 | ITGB2 (0.38) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL3133241 | 0.86 | ITGB2 (0.38) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL25181254 | 0.84 | NPC1 (0.32) | ITGB2ICAM1ITGALNPC1RAB9A | |
| SCHEMBL3132985 | 0.84 | ITGB2 (0.46) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL19928557 | 0.82 | DRD1 (0.36) | DRD1ITGB2ICAM1ITGALCYP3A4 | |
| SCHEMBL27715213 | 0.80 | MAOB (0.41) | DRD1CYP3A4TDP1TSHRSMN1; SMN2 | |
| SCHEMBL9913796 | 0.79 | DRD1 (0.36) | DRD1ITGB2ICAM1ITGALCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2531486-B1 | NOVEL PROCESS FOR THE PREPARATION OF NITROGEN SUBSTITUTED AMINOTETRALINS DERIVATIVES | UCB BIOPHARMA SPRL (BE) | 2017-06-21 | — | — | EP | claimed |