Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 3/20 | 0.34 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.33 |
| ▸ | SCD | O00767 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10991959 | 1.00 | NPC1 (0.39) | NPC1RAB9AALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL11205775 | 0.82 | ALDH1A1 (0.41) | NPC1RAB9AALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL11205771 | 0.82 | ALDH1A1 (0.41) | NPC1RAB9AALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL11022877 | 0.82 | NPC1 (0.35) | NPC1RAB9AALDH1A1PLA2G1BNFKB1 | |
| SCHEMBL11206844 | 0.80 | PLAU (0.45) | NPC1RAB9AALDH1A1METAP2MEN1 | |
| SCHEMBL31130657 | 0.80 | PLAU (0.45) | NPC1RAB9AALDH1A1METAP2MEN1 | |
| SCHEMBL10708780 | 0.80 | PLAU (0.45) | NPC1RAB9AALDH1A1METAP2MEN1 | |
| SCHEMBL10936719 | 0.76 | NOS3 (0.41) | NPC1RAB9AALDH1A1L3MBTL1KIF11 | |
| SCHEMBL31493860 | 0.73 | HSD17B10 (0.44) | ALDH1A1L3MBTL1ALOX15HSD17B10 | |
| SCHEMBL9976117 | 0.73 | HSD17B10 (0.44) | ALDH1A1L3MBTL1ALOX15HSD17B10 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0289180-A2 | Method of chlorination | PFIZER INC. (US) | 1988-11-02 | — | — | EP | disclosed |
| US-4659829-A | COMPLEXED WITH A TRIDENTATED LIQUID OF 1,3-BIS(2-PYRIDYLIMINO)ISOINDOLINES | INSTITUT FRANCAIS DU PETROLE (FR) | 1987-04-21 | — | — | US | disclosed |
| US-4499305-A | FORMING STABLE DISPERSIONS OF A TRANSITION METAL COMPLEX AND 1,3-BIS/2-PYRIDYLIMINO/ISOINDOLINE IN CYCLOHEXANOL, CYCLOHEXANONE AND/OR CYCLOHEXANE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1985-02-12 | — | — | US | disclosed |
| US-4326084-A | TRANSITION METAL COMPLEX OF 1,3-BIS/PYRIDYLIMINO/ISOINDOLINE AS OXIDATION CATALYST | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1982-04-20 | — | — | US | disclosed |
| EP-0027937-A1 | Improved process for producing a mixture containing cyclohexanol and cyclohexanone from cyclohexane | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1981-05-06 | — | — | EP | disclosed |