Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | STS | P08842 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15100859 | 0.88 | KMT2A (0.54) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL11814930 | 0.88 | ALDH1A1 (0.55) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL8864729 | 0.88 | ALDH1A1 (0.66) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL14601572 | 0.87 | KMT2A (0.57) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL11576360 | 0.85 | CYP1A2 (0.70) | KMT2AHTTALDH1A1MEN1CES2 | |
| SCHEMBL11575925 | 0.85 | CYP1A2 (0.68) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL9365255 | 0.84 | CYP1A2 (0.67) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL10623624 | 0.83 | KMT2A (0.51) | KMT2ANPC1RAB9AHTTALDH1A1 | |
| SCHEMBL11577347 | 0.83 | STS (0.54) | NPC1RAB9AHTTALDH1A1STS | |
| SCHEMBL4032231 | 0.82 | NPC1 (0.50) | KMT2ANPC1RAB9AHTTALDH1A1 |
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-4115413-A | ACID FREE | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-19 | — | — | US | disclosed |