Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 12/20 | 0.76 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | RARA | P10276 | 1/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10418840 | 0.92 | RARB (0.89) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL8371650 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9734086 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9744977 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9733644 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL5687511 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL9817507 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL8534144 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| SCHEMBL4186000 | 0.86 | RARB (1.00) | RARBRAB9ASMN1; SMN2NPC1NFKB1 | |
| Hydrochloric Acid SCHEMBL9323786 | 0.85 | RARB (0.97) | RARBRAB9ASMN1; SMN2NPC1NFKB1 |
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-4980486-A | Phenyl isothiocyanates | HOFFMANN-LA ROCHE INC. (US) | 1990-12-25 | — | — | US | disclosed |
| US-4915480-A | Liquid crystalline compounds and mixtures | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-04-10 | — | — | US | disclosed |