Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL28164782 | 0.76 | MEN1 (0.52) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| Ethane SCHEMBL20528159 | 0.76 | MEN1 (0.52) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| SCHEMBL535883 | 0.76 | MEN1 (0.52) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| SCHEMBL7565591 | 0.76 | MEN1 (0.52) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| SCHEMBL7670045 | 0.75 | — | — | |
| SCHEMBL7626568 | 0.74 | MEN1 (0.50) | ALDH1A1MEN1KMT2ATSHRKDM4E | |
| SCHEMBL27573610 | 0.74 | MEN1 (0.50) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| SCHEMBL1963 | 0.74 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2ATSHRCYP2C9 | |
| SCHEMBL56546 | 0.74 | — | — | |
| SCHEMBL3160237 | 0.74 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ATSHRKDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0846684-A2 | Process for producing 2-halo-nicotinic acid derivatives and precursors thereto | REILLY INDUSTRIES, INC. (US) | 1998-06-10 | — | — | EP | disclosed |
| US-5493028-A | Processes for producing 2-Halo-nicotinic acid derivatives and precursors thereto | REILLY INDUSTRIES, INC. (US) | 1996-02-20 | — | — | US | disclosed |
| EP-0633880-A1 | PROCESSES FOR PRODUCING 2-HALO-NICOTINIC ACID DERIVATIVES AND PRECURSORS THERETO | REILLY INDUSTRIES, INC. (US) | 1995-01-18 | — | — | EP | disclosed |
| WO-1993018005-A2 | PROCESSES FOR PRODUCING 2-HALO-NICOTINIC ACID DERIVATIVES AND PRECURSORS THERETO | REILLY INDUSTRIES, INC. (US) | 1993-09-16 | — | — | WO | disclosed |