Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 3/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | MAX | P61244 | 1/20 | 0.36 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2334225 | 0.82 | L3MBTL1 (0.48) | ATMTDP1L3MBTL1CYP1A2 | |
| SCHEMBL29858393 | 0.79 | ASH1L (0.45) | MTORHDAC1HDAC2CYP1A2CYP2D6 | |
| SCHEMBL5226675 | 0.79 | ASH1L (0.45) | MTORHDAC1HDAC2CYP1A2CYP2D6 | |
| SCHEMBL28879963 | 0.79 | MTOR (0.41) | MTORHDAC1HDAC2GRM5F2 | |
| SCHEMBL4083166 | 0.77 | HDAC1 (0.41) | MTORHDAC1HDAC2GRM5F2 | |
| SCHEMBL29532021 | 0.76 | CA12 (0.58) | MTORMYCTDP1L3MBTL1CYP1A2 | |
| SCHEMBL40282 | 0.76 | CA12 (0.58) | MTORMYCTDP1L3MBTL1CYP1A2 | |
| Hydrochloric Acid SCHEMBL4455397 | 0.74 | CA12 (0.56) | MTORMYCTDP1L3MBTL1CYP1A2 | |
| Methane SCHEMBL14879758 | 0.74 | CA12 (0.56) | MTORMYCTDP1L3MBTL1CYP1A2 | |
| SCHEMBL2287116 | 0.74 | MTOR (0.38) | MTORHDAC1HDAC2GRM5F2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5204482-A | Ethylenediamine monoamide heteroaryl derivatives | HOFFMAN-LAROCHE INC. (US) | 1993-04-20 | — | — | US | disclosed |
| US-5011849-A | Monoamine oxidase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 1991-04-30 | — | — | US | disclosed |