Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | REN | P00797 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11321849 | 0.82 | CES1 (0.52) | KMT2AMEN1ALDH1A1CES2CES1 | |
| SCHEMBL11680944 | 0.81 | ALOX5 (0.49) | NPC1RAB9AKMT2AMEN1CES2 | |
| SCHEMBL9061013 | 0.79 | CES2 (0.48) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL9730640 | 0.77 | MCL1 (0.46) | KMT2AMEN1CES2CES1AKR1B1 | |
| SCHEMBL29291237 | 0.76 | CES1 (0.54) | KMT2AMEN1ALDH1A1CES2CES1 | |
| SCHEMBL27470447 | 0.76 | MEN1 (0.48) | KMT2AMEN1CES2CES1ALOX5 | |
| SCHEMBL8711613 | 0.76 | ALOX5 (0.47) | NPC1RAB9AALDH1A1CES2CES1 | |
| SCHEMBL8456803 | 0.76 | ALDH1A1 (0.50) | NPC1RAB9AKMT2AMEN1TDP1 | |
| SCHEMBL4430452 | 0.75 | CES2 (0.52) | NPC1RAB9AKMT2AMEN1CES2 | |
| SCHEMBL9052467 | 0.74 | TSHR (0.39) | NPC1RAB9AKMT2AMEN1TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0914319-A1 | DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS | TEIJIN LIMITED (JP) | 1999-05-12 | — | — | EP | disclosed |
| WO-1997044329-A1 | DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS | TEIJIN LIMITED (JP) | 1997-11-27 | — | — | WO | disclosed |