Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | FBP1 | P09467 | 3/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL60622 | 0.75 | ALDH1A1 (0.46) | ALDH1A1TSHRAKR1C3AKR1C1ESR1 | |
| SCHEMBL15579002 | 0.73 | AKR1C3 (0.50) | ALDH1A1TSHRAKR1C3AKR1C1MEN1 | |
| SCHEMBL15579003 | 0.73 | AKR1C3 (0.50) | ALDH1A1TSHRAKR1C3AKR1C1MEN1 | |
| SCHEMBL8072809 | 0.73 | ALDH1A1 (0.48) | ALDH1A1TSHRAKR1C3AKR1C1ESR1 | |
| SCHEMBL28376668 | 0.72 | TSHR (0.39) | ALDH1A1TSHRAKR1C3AKR1C1ESR1 | |
| SCHEMBL29253620 | 0.69 | ALDH1A1 (0.50) | ALDH1A1TSHRAKR1C3AKR1C1ESR1 | |
| SCHEMBL131223 | 0.69 | MAOB (0.53) | ALDH1A1TSHRAKR1C3AKR1C1ESR1 | |
| SCHEMBL6551351 | 0.67 | AKR1C1 (0.52) | ALDH1A1TSHRAKR1C3AKR1C1MEN1 | |
| (Z)-1,2-Diphenylethene SCHEMBL3792039 | 0.67 | MAOB (0.58) | MEN1KMT2AMAOB | |
| (Z)-1,2-Diphenylethene SCHEMBL3792042 | 0.67 | MAOB (0.58) | MEN1KMT2AMAOB |
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-5486633-A | REMOVABLE PROTECTIVE GROUPS ON BIOPOLYMERS WITH MERCAPTO-, HYDROXY- OR AMINO GROUPS | DUKE UNIVERSITY (US) | 1996-01-23 | — | — | US | disclosed |