Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.36 |
| ▸ | CFD | P00746 | 2/20 | 0.36 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ILK | Q13418 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL17185171 | 0.87 | KDM4E (0.46) | POLBKDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL17185448 | 0.79 | POLB (0.48) | CYP4F2CYP4A11POLBKDM4ETNFSF11 | |
| SCHEMBL16637297 | 0.79 | SOS1 (0.44) | POLBKDM4EPKMHSD17B10ALDH1A1 | |
| SCHEMBL17185131 | 0.77 | CYP4F2 (0.39) | CYP4F2CYP4A11POLBKDM4ECFD | |
| SCHEMBL167840 | 0.75 | POLB (0.38) | POLBKDM4ECFDTNFSF11PKM | |
| SCHEMBL168791 | 0.74 | GAA (0.46) | POLBKDM4ECFDTNFSF11HSD17B10 | |
| SCHEMBL166010 | 0.74 | KDM4E (0.41) | POLBKDM4ECFDTNFSF11PKM | |
| SCHEMBL30738282 | 0.73 | SOS1 (0.44) | POLBKDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL21585802 | 0.73 | SOS1 (0.44) | POLBKDM4EHSD17B10ALDH1A1HPGD | |
| SCHEMBL522786 | 0.72 | CA12 (0.47) | POLBKDM4EHSD17B10ALDH1A1HPGD |
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-2015161011-A1 | BENZAMIDE CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2015-10-22 | — | — | WO | disclosed |