Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9424924 | 0.81 | MAPT (0.51) | CYP1A2MEN1KMT2AHDAC1TDP1 | |
| SCHEMBL9433003 | 0.81 | HDAC1 (0.46) | CYP1A2MEN1KMT2AKIF11NR1H4 | |
| SCHEMBL9501933 | 0.80 | MAPT (0.44) | CYP1A2MEN1KMT2AEPHX2LMNA | |
| SCHEMBL8494650 | 0.80 | SMN1; SMN2 (0.47) | CYP1A2MEN1KMT2ANR1H4EPHX2 | |
| SCHEMBL8148677 | 0.78 | ESR1 (0.52) | CYP1A2MEN1KMT2ALMNACYP3A4 | |
| SCHEMBL28915433 | 0.78 | NPC1 (0.46) | CYP1A2MEN1KMT2AKIF11LMNA | |
| SCHEMBL1492728 | 0.77 | CYP2C19 (0.50) | CYP1A2KMT2AKIF11HDAC1CYP2D6 | |
| SCHEMBL15827159 | 0.77 | CYP26B1 (0.40) | CYP1A2MEN1KMT2AHDAC1CYP3A4 | |
| SCHEMBL20556837 | 0.77 | MIF (0.48) | CYP1A2MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL5794046 | 0.77 | KDM4E (0.44) | CYP1A2MEN1KMT2AKIF11HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5317103-A | Migraine treatment | MERCK SHARP & DOHME LIMITED (GB) | 1994-05-31 | — | — | US | disclosed |