Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | CD4 | P01730 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8977392 | 0.79 | CHRNA7 (0.35) | HTR2AHTR2CKMT2AC5AR1MAPT | |
| SCHEMBL8977387 | 0.69 | CYP3A4 (0.32) | CYP3A4 | |
| SCHEMBL8452447 | 0.66 | TLR4 (0.37) | KMT2AMAPTCYP3A4SMN1; SMN2MEN1 | |
| SCHEMBL1621403 | 0.64 | C5AR1 (0.57) | KMT2AC5AR1MAPTNPSR1CYP2C9 | |
| SCHEMBL8977326 | 0.62 | MAPT (0.38) | KMT2AMAPTTDP1SMN1; SMN2MEN1 | |
| SCHEMBL7971332 | 0.60 | GAA (0.50) | KMT2AMAPTTDP1CYP3A4CYP2C19 | |
| SCHEMBL31108761 | 0.59 | MEN1 (0.42) | HTR2AKMT2AMAPTCYP3A4SMN1; SMN2 | |
| SCHEMBL17449295 | 0.59 | MEN1 (0.42) | HTR2AKMT2AMAPTCYP3A4SMN1; SMN2 | |
| SCHEMBL14062319 | 0.59 | ACHE (0.49) | HTR2AHTR2CKMT2AC5AR1MAPT | |
| Formaldehyde SCHEMBL28205505 | 0.58 | TSHR (0.41) | KMT2ACYP3A4SMN1; SMN2MEN1POLB |
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-5545741-A | Process for the preparation of epibatidine | EGIS GYOGYSZERGYAR RT. (HU) | 1996-08-13 | — | — | US | disclosed |