Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17845992 | 0.89 | KMT2A (0.49) | TMEM97SIGMAR1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL17846142 | 0.87 | SLC16A3 (0.48) | TMEM97SIGMAR1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL29157005 | 0.85 | TMEM97 (0.55) | MTNR1AMTNR1BTMEM97SIGMAR1HIF1A | |
| SCHEMBL17258879 | 0.82 | ALDH1A1 (0.49) | TMEM97SIGMAR1NPC1RAB9AL3MBTL1 | |
| SCHEMBL20564338 | 0.81 | MTNR1A (0.44) | MTNR1AMTNR1BL3MBTL1ALDH1A1MAPT | |
| SCHEMBL10348018 | 0.80 | ALDH1A1 (0.54) | MTNR1AMTNR1BALDH1A1KMT2AMAPT | |
| SCHEMBL3822300 | 0.80 | L3MBTL1 (0.42) | MTNR1AMTNR1BL3MBTL1ALDH1A1KMT2A | |
| SCHEMBL11263494 | 0.79 | KEAP1 (0.48) | L3MBTL1ALDH1A1SMN1; SMN2POLBITGB3 | |
| SCHEMBL20563681 | 0.78 | HPGD (0.47) | MTNR1AMTNR1BNPC1RAB9AALDH1A1 | |
| SCHEMBL5671835 | 0.77 | MTNR1A (0.57) | MTNR1AMTNR1BNPC1RAB9AALDH1A1 |
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-3233859-A1 | ERK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016100051-A1 | ERK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2016-06-23 | — | — | WO | disclosed |