Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | APOBEC3A | P31941 | 3/20 | 0.59 |
| ▸ | APOBEC3G | Q9HC16 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | PRCP | P42785 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL23748846 | 0.98 | APOBEC3A (0.61) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL23748809 | 0.92 | OPRM1 (0.56) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL23225664 | 0.84 | OPRM1 (0.73) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL6660823 | 0.82 | OPRM1 (0.75) | APOBEC3AAPOBEC3GHTTSIGMAR1PRCP | |
| SCHEMBL27101945 | 0.80 | APOBEC3A (0.59) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL329509 | 0.79 | AKR1C1 (0.68) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL23225663 | 0.79 | OPRM1 (0.75) | APOBEC3AAPOBEC3GSIGMAR1PRCPALDH1A1 | |
| SCHEMBL24131750 | 0.78 | APOBEC3A (0.60) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL8545254 | 0.78 | AKR1C1 (0.61) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 | |
| SCHEMBL1038755 | 0.78 | HDAC4 (0.62) | MAPK1APOBEC3AAPOBEC3GHTTSIGMAR1 |
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-3863629-A1 | PRODRUGS OF CGRP ANTAGONISTS | Biohaven Pharmaceutical Holding Company Ltd. (US) | 2021-08-18 | — | — | EP | disclosed |