Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KAT2B | Q92831 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12515108 | 0.92 | KAT2B (0.47) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL12514853 | 0.88 | SMN1; SMN2 (0.48) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL1594633 | 0.85 | MAPT (0.56) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL27688992 | 0.84 | HCAR3 (0.63) | ALDH1A1NPSR1KAT2BMAPTPKM | |
| SCHEMBL14933944 | 0.84 | ALDH1A1 (0.53) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL2336839 | 0.81 | HCAR3 (0.61) | ALDH1A1KAT2BMAPTPKMPOLB | |
| SCHEMBL19972855 | 0.81 | HCAR3 (0.66) | ALDH1A1SMN1; SMN2KAT2BMAPTPKM | |
| SCHEMBL8985609 | 0.80 | KAT2B (0.57) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL9498147 | 0.80 | ALDH1A1 (0.48) | ALDH1A1NPSR1HDAC1SMN1; SMN2KAT2B | |
| SCHEMBL2469009 | 0.80 | KAT2B (0.58) | ALDH1A1SMN1; SMN2KAT2BMAPTTSHR |
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-RE30798-E | BY REACTING 4-FLUORO-3-NITROANILINES WITH AMMONIA OR A PRIMARY OR SECONDARY AMINE | CLAIROL INCORPORATED (US) | 1981-11-17 | — | — | US | disclosed |