Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28609005 | 0.86 | L3MBTL1 (0.62) | GAACYP3A4CYP2D6CYP2C19MAPT | |
| SCHEMBL27753495 | 0.86 | L3MBTL1 (0.62) | GAACYP3A4CYP2D6CYP2C19MAPT | |
| SCHEMBL2607000 | 0.85 | ALDH1A1 (0.57) | TSHRGAACYP3A4EPHX2KMT2A | |
| SCHEMBL8464631 | 0.85 | ALDH1A1 (0.57) | TSHRGAACYP3A4EPHX2KMT2A | |
| SCHEMBL2607312 | 0.85 | ALDH1A1 (0.57) | TSHRGAACYP3A4EPHX2KMT2A | |
| SCHEMBL25822917 | 0.85 | ALDH1A1 (0.57) | TSHRGAACYP3A4EPHX2KMT2A | |
| SCHEMBL2607206 | 0.83 | CYP1A2 (0.57) | TSHRGAACYP3A4EPHX2KMT2A | |
| SCHEMBL8630173 | 0.83 | L3MBTL1 (0.67) | GAACYP3A4CYP2D6CYP2C19MAPT | |
| SCHEMBL13347347 | 0.82 | TSHR (0.57) | TSHRGAAMAPTSMN1; SMN2EPHX2 | |
| SCHEMBL6898417 | 0.82 | CYP3A4 (0.58) | GAACYP3A4CYP2D6CYP2C19MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5981580-A | IN WHICH THE CARBOXY-TERMINUS HAS BEEN MODIFIED TO FORM VARIOUS AMIDES, ESTERS, KETONES, ALCOHOLS, ALCOHOL ESTERS AND NITRITES THEREOF, AND ARE USEFUL AS SUBSTRATES FOR N-MYRISTOYLTRANSFERASE (NMT) AND/OR ITS ACYL COENZYME | G. D. SEARLE & CO. (US) | 1999-11-09 | — | — | US | disclosed |
| US-5599947-A | VIRICIDES, FUNGICIDES OR THEIR PRODRUGS | G. D. SEARLE & CO. (US) | 1997-02-04 | — | — | US | disclosed |