Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7419389 | 0.81 | CYP1A2 (0.53) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL6733057 | 0.81 | TSHR (0.58) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL7011029 | 0.80 | NAMPT (0.57) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL7416787 | 0.77 | TSHR (0.55) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL14380633 | 0.76 | CA2 (0.61) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL3597587 | 0.76 | TSHR (0.60) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL5652939 | 0.76 | CYP1A2 (0.58) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| SCHEMBL1099625 | 0.75 | TSHR (0.52) | CYP1A2CYP2C19TSHRCYP2D6POLB | |
| Acetic Acid SCHEMBL28216269 | 0.74 | MAPT (0.56) | CYP1A2CYP2C19TSHRPOLBCYP3A4 | |
| SCHEMBL7007840 | 0.72 | TDP1 (0.53) | CYP1A2CYP2C19TSHRCYP2D6POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1255735-A2 | PYRIDINE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS | ELI LILLY AND COMPANY (US) | 2002-11-13 | — | — | EP | claimed |
| WO-2001056990-A2 | PYRIDINE DERIVATES AS POTENTIATORS OF GLUTAMATE RECEPTORS | ELI LILLY AND COMPANY (US) | 2001-08-09 | — | — | WO | claimed |