Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LPL | P06858 | 1/20 | 0.41 |
| ▸ | LIPC | P11150 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | 0.98 | KMT2A (0.49) | SLC16A3KMT2ATMEM97SIGMAR1TRPV1 | |
| SCHEMBL17846112 | 0.87 | MTNR1A (0.45) | SLC16A3KMT2ATMEM97SIGMAR1SMN1; SMN2 | |
| SCHEMBL17750800 | 0.81 | MTNR1A (0.51) | TMEM97SIGMAR1 | |
| SCHEMBL10372113 | 0.81 | MAPT (0.54) | SLC16A3SMN1; SMN2 | |
| SCHEMBL11260789 | 0.80 | MAPT (0.51) | SLC16A3SMN1; SMN2 | |
| SCHEMBL17846186 | 0.80 | SLC6A5 (0.53) | TRPV1HPGDNAAAALDH1A1 | |
| SCHEMBL17846146 | 0.78 | TRPV1 (0.46) | KMT2ATRPV1HPGDSMN1; SMN2NAAA | |
| SCHEMBL17846090 | 0.78 | SLC6A5 (0.54) | TRPV1HPGDALDH1A1 | |
| SCHEMBL11266416 | 0.78 | HDAC3 (0.52) | SLC16A3KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL17258879 | 0.77 | ALDH1A1 (0.49) | KMT2ATMEM97SIGMAR1HPGDPOLB |
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 |