Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.56 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.56 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MEN1 | O00255 | 6/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.52 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.52 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.52 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6632890 | 0.86 | TP53 (0.68) | TSHRCES2CES1TP53ALDH1A1 | |
| SCHEMBL11589885 | 0.85 | TSHR (0.59) | TSHRCES2CES1TP53PRSS1 | |
| SCHEMBL29964351 | 0.85 | TSHR (0.59) | TSHRCES2CES1TP53PRSS1 | |
| SCHEMBL8962602 | 0.84 | SMN1; SMN2 (0.63) | TSHRCES2CES1TP53PRSS1 | |
| SCHEMBL10341585 | 0.83 | CES2 (0.60) | TSHRCES2CES1TP53PRSS1 | |
| SCHEMBL10691910 | 0.83 | CES2 (0.60) | TSHRCES2CES1TP53PRSS1 | |
| Carbamic Acid SCHEMBL27919491 | 0.83 | TSHR (0.70) | TSHRCES2CES1TP53PRSS1 | |
| Urea SCHEMBL28125526 | 0.83 | TSHR (0.70) | TSHRCES2CES1TP53PRSS1 | |
| SCHEMBL11059943 | 0.83 | LMNA (0.67) | TSHRCES2CES1ALDH1A1MEN1 | |
| SCHEMBL894417 | 0.82 | TSHR (1.00) | TSHRCES2CES1TP53PRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4447515-A | DIACYLAMINE COMPOUND ADDED | FUJI PHOTO FILM CO., LTD. (JP) | 1984-05-08 | — | — | US | disclosed |