Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.45 |
| ▸ | CTSB | P07858 | 3/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | PTPRG | P23470 | 1/20 | 0.37 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.37 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8499284 | 0.79 | PNMT (0.52) | POLB | |
| SCHEMBL15936058 | 0.78 | AKR1C2 (0.58) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL1244892 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL6479259 | 0.76 | ANPEP (0.49) | ALDH1A1TP53TDP1KDM4EPOLB | |
| SCHEMBL1245996 | 0.75 | CA2 (0.59) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL13622158 | 0.73 | ALDH1A1 (0.59) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL30402090 | 0.72 | CYP4F2 (0.61) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL844419 | 0.72 | CYP4F2 (0.61) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL1671897 | 0.72 | ALDH1A1 (0.57) | ALDH1A1TP53MRGPRX4CTSBTDP1 | |
| SCHEMBL19443060 | 0.72 | ALDH1A1 (0.57) | ALDH1A1TP53MRGPRX4CTSBTDP1 |
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-4145362-A | DIAZOTIZATION OF ARYLAMINE IN PRESENCE OF ALKANOIC ACID, COPPER HALIDE CATALYST | S.A. P R B EN NEERLANDAIS PRB N.V. (BE) | 1979-03-20 | — | — | US | disclosed |