Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.42 |
| ▸ | CPT1A | P50416 | 1/20 | 0.41 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL1018588 | 0.78 | KMT2A (0.64) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL16619147 | 0.77 | MEN1 (0.36) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| Hydrochloric Acid SCHEMBL9015381 | 0.76 | KMT2A (0.62) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL3038994 | 0.75 | LTA4H (0.57) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL29145870 | 0.74 | KMT2A (0.51) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL6051027 | 0.71 | ALOX15 (0.45) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL4237429 | 0.69 | HRH3 (0.44) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL28215481 | 0.69 | MRGPRX4 (0.58) | KMT2AMEN1ALDH1A1MRGPRX4TSHR | |
| SCHEMBL13731010 | 0.68 | KMT2A (0.51) | KMT2AALDH1A1MRGPRX4TSHRMDM2 | |
| SCHEMBL11057819 | 0.67 | NPC1 (0.56) | KMT2AMEN1ALDH1A1TSHRMDM2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015050798-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2015-04-09 | — | — | WO | disclosed |