Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | USP2 | O75604 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1787541 | 0.87 | USP2 (0.69) | TP53USP2KMT2ALMNASMN1; SMN2 | |
| SCHEMBL28799843 | 0.84 | LMNA (0.54) | TP53USP2CYP1A2KMT2ACYP2C19 | |
| SCHEMBL29351857 | 0.82 | USP2 (0.64) | TP53USP2CYP1A2KMT2ACYP2C19 | |
| SCHEMBL7663868 | 0.82 | USP2 (0.64) | TP53USP2CYP1A2KMT2ACYP2C19 | |
| SCHEMBL22675387 | 0.81 | USP2 (0.55) | TP53USP2CYP1A2KMT2ACYP2C19 | |
| SCHEMBL8956100 | 0.81 | LMNA (0.51) | TP53USP2LMNAHTTSMN1; SMN2 | |
| SCHEMBL11620182 | 0.81 | LMNA (0.51) | TP53USP2CYP1A2KMT2ACYP2C19 | |
| SCHEMBL7129795 | 0.80 | MEN1 (0.62) | TP53USP2KMT2ALMNAALDH1A1 | |
| SCHEMBL71493 | 0.79 | L3MBTL1 (0.56) | KMT2ACYP2C19LMNAHTTSMN1; SMN2 | |
| SCHEMBL1515749 | 0.76 | PTPN1 (0.59) | TP53USP2KMT2AALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0659744-B1 | Process of preparation of hexahydroazepinones and hexahydroazepinoles | ASTA MEDICA AG (DE) | 2001-02-28 | — | — | EP | claimed |
| US-6180629-B1 | INDUCING OR PROMOTING APOPTOSIS AND FOR ARRESTING UNCONTROLLED NEOPLASTIC CELL PROLIFERATION, INCLUDING PRECANCEROUS AND CANCEROUS LESIONS | CELL PATHWAYS, INC. | 2001-01-30 | — | — | US | disclosed |
| US-4841047-A | ANTIALLERGENS | AASTA PHARMA AG (DE) | 1989-06-20 | — | — | US | disclosed |
| CN-86107627-A | The preparation method of novel 4-benzyl-1-(2H)-phthalazinone derivatives | — | 1987-07-15 | — | — | CN | disclosed |