Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20226989 | 0.77 | HTT (0.37) | MEN1KMT2ANPC1RAB9AHTT | |
| SCHEMBL7263191 | 0.75 | NPC1 (0.53) | MEN1KMT2ANPC1RAB9AHPGD | |
| SCHEMBL3355255 | 0.74 | HTT (0.55) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL3355462 | 0.72 | HTT (0.53) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL30982659 | 0.70 | HTT (0.51) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL30982466 | 0.70 | HTT (0.51) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL30982820 | 0.70 | HTT (0.51) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL3357548 | 0.70 | HTT (0.51) | MEN1KMT2ANPC1HTTHPGD | |
| SCHEMBL2115663 | 0.69 | LMNA (0.50) | MEN1KMT2ANPC1RAB9AHTT | |
| SCHEMBL2466155 | 0.69 | MAPK14 (0.44) | MEN1KMT2ANPC1RAB9AHPGD |
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-2018102634-A1 | TRICYCLIC HETEROCYCLE COMPOUNDS USEFUL AS HIV INTEGRASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-06-07 | — | — | WO | disclosed |