Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28321402 | 0.81 | ALDH1A1 (0.44) | TSHRTP53RAB9AMAPTALDH1A1 | |
| SCHEMBL244815 | 0.81 | EPHX1 (0.52) | NPC1RAB9ACA2CA9CA14 | |
| SCHEMBL5519988 | 0.78 | ALDH1A1 (0.41) | NPC1RAB9ACA2CA9MAPT | |
| SCHEMBL11589521 | 0.76 | TDP1 (0.45) | TSHRNPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL7125183 | 0.76 | ALDH1A1 (0.40) | NPC1RAB9AMAPTALDH1A1GAA | |
| SCHEMBL2094001 | 0.76 | NPC1 (0.41) | NPC1RAB9AMAPTNPSR1ALDH1A1 | |
| SCHEMBL6783917 | 0.76 | RAPGEF4 (0.46) | NPC1RAB9AMAPTALDH1A1KDM4E | |
| SCHEMBL6371441 | 0.74 | CA1 (0.48) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL8410032 | 0.73 | SLC22A12 (0.51) | ALDH1A1BLM | |
| SCHEMBL3792814 | 0.72 | TSHR (0.50) | TSHRTP53NPC1RAB9ACA12 |
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-6218565-B1 | 1-FLUORO-2,4-DIAMINO-BENZENE IS REACTED WITH SULPHONYL CHLORIDES, CARBONYL CHLORIDES OR CHLORORFORMIC ESTERS IN THE PRESENCE OF AN ACID ACCEPTOR AND IN THE PRESENCE OF A DILUENT | BAYER AKTIENGESELLSCHAFT (DE) | 2001-04-17 | — | — | US | disclosed |