Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15797752 | 0.77 | PDCD1 (0.43) | PDCD1CD274HTTSMN1; SMN2NPC1 | |
| SCHEMBL4863098 | 0.74 | CES2 (0.50) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| SCHEMBL7797898 | 0.74 | CES1 (0.41) | ALDH1A1LMNATSHRTDP1GAA | |
| SCHEMBL27922016 | 0.72 | MTNR1A (0.48) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| SCHEMBL27498418 | 0.72 | MTNR1A (0.48) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| SCHEMBL27589809 | 0.72 | MTNR1A (0.48) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| SCHEMBL28385832 | 0.72 | MTNR1A (0.48) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| SCHEMBL27573431 | 0.72 | MTNR1A (0.48) | SMN1; SMN2MAPTALDH1A1LMNATSHR | |
| Benzoic Acid 1-Methylethyl Ester SCHEMBL96918 | 0.72 | PDCD1 (0.78) | PDCD1CD274HTTSMN1; SMN2NPC1 | |
| Benzoic Acid 1-Methylethyl Ester SCHEMBL27592410 | 0.72 | PDCD1 (0.78) | PDCD1CD274HTTSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2203496-B1 | PHOTOLATENT CATALYSTS BASED ON ORGANOMETALLIC COMPOUNDS | BASF SE (DE) | 2018-04-11 | — | — | EP | disclosed |