Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 1/20 | 0.39 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11654437 | 0.91 | SMN1; SMN2 (0.46) | TDP1L3MBTL1 | |
| SCHEMBL11657750 | 0.89 | TBXA2R (0.48) | CASR | |
| SCHEMBL11656355 | 0.89 | MAPK1 (0.51) | TSHRMAPK1TDP1L3MBTL1 | |
| SCHEMBL11657549 | 0.89 | NPC1 (0.40) | MAPK1L3MBTL1 | |
| SCHEMBL11659488 | 0.89 | HPGD (0.37) | TSHRMAPK1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL11670228 | 0.89 | ABCB1 (0.46) | — | |
| SCHEMBL11656949 | 0.89 | TBXA2R (0.38) | MAPK1ALDH1A1L3MBTL1CYSLTR2CYSLTR1 | |
| SCHEMBL11657093 | 0.88 | TSHR (0.50) | TSHRMAPK1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL11661605 | 0.87 | HIF1A (0.37) | MAPK1L3MBTL1MTNR1AMTNR1BCYSLTR2 | |
| SCHEMBL11655520 | 0.87 | KDM4E (0.40) | ALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4126629-A | FERTILITY CONTROL | MERCK & CO., INC. (US) | 1978-11-21 | — | — | US | disclosed |
| US-4061643-A | ANTIFERTILITY | MERCK & CO., INC. (US) | 1977-12-06 | — | — | US | disclosed |
| US-4020177-A | CONTRACEPTIVES | MERCK & CO., INC. (US) | 1977-04-26 | — | — | US | disclosed |