Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.35 |
| ▸ | LAP3 | P28838 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | ALPI | P09923 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28442226 | 0.65 | NPC1 (0.40) | MEN1KMT2AMAPTCYP2C9CYP2C19 | |
| SCHEMBL5170532 | 0.65 | POLB (0.35) | MEN1KMT2AMAPTPOLBHSD17B10 | |
| SCHEMBL3980617 | 0.64 | KMT2A (0.55) | MEN1KMT2AMAPTPOLBCYP2C9 | |
| SCHEMBL180159 | 0.64 | KMT2A (0.55) | MEN1KMT2AMAPTPOLBCYP2C9 | |
| SCHEMBL979240 | 0.64 | KMT2A (0.55) | MEN1KMT2AMAPTPOLBCYP2C9 | |
| SCHEMBL28350465 | 0.62 | TSHR (0.37) | MEN1KMT2AMAPTPOLBCYP2C9 | |
| SCHEMBL105702 | 0.62 | ALPI (0.55) | POLBALPIPKMPTGS1XIAP | |
| SCHEMBL4352250 | 0.62 | CYP1A2 (0.54) | POLBHSD17B10SRRALPIPKM | |
| SCHEMBL3432001 | 0.62 | EPHX1 (0.60) | POLBL3MBTL1SRRLAP3ALDH1A1 | |
| SCHEMBL414455 | 0.62 | EPHX1 (0.60) | POLBL3MBTL1SRRLAP3ALDH1A1 |
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-5616799-A | REACTING A CORRESPONDING NITRO COMPOUND WITH A KETONE AND HYDROGEN IN PRESENCE OF A NOBLE METAL CATALYST | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-04-01 | — | — | US | disclosed |