Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | MTOR | P42345 | 2/20 | 0.68 |
| ▸ | JAK2 | O60674 | 1/20 | 0.68 |
| ▸ | GMNN | O75496 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 1/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | GLA | P06280 | 1/20 | 0.68 |
| ▸ | CTSG | P08311 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | PKM | P14618 | 1/20 | 0.68 |
| ▸ | HPGD | P15428 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.68 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL6811031 | 0.91 | PIK3CG (0.64) | ALDH1A1KDM4EMTORJAK2GMNN | |
| SCHEMBL14524242 | 0.82 | PIK3CG (0.69) | ALDH1A1KDM4EMTORJAK2GMNN | |
| Triamterene SCHEMBL40707 | 0.81 | ALDH1A1 (1.00) | ALDH1A1KDM4EMTORJAK2GMNN | |
| Triamterene SCHEMBL29531410 | 0.81 | ALDH1A1 (1.00) | ALDH1A1KDM4EMTORJAK2GMNN | |
| Triamterene SCHEMBL5421685 | 0.81 | ALDH1A1 (1.00) | ALDH1A1KDM4EMTORJAK2GMNN | |
| Triamterene SCHEMBL11044581 | 0.80 | ALDH1A1 (0.97) | ALDH1A1KDM4EMTORJAK2GMNN | |
| Dimethylamine SCHEMBL10566645 | 0.75 | ALDH1A1 (0.69) | ALDH1A1KDM4EMTORJAK2GMNN | |
| SCHEMBL10894514 | 0.74 | ALDH1A1 (0.87) | ALDH1A1KDM4EMTORJAK2GMNN | |
| SCHEMBL6819013 | 0.74 | NOS1 (0.56) | ALDH1A1KDM4ELMNATP53MAPK1 | |
| SCHEMBL17407823 | 0.73 | ADORA2A (0.47) | ALDH1A1KDM4EPKMMAPTMEN1 |
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-1216246-B1 | N-SUBSTITUTED 4-AMINOPTERIDINES, SYNTHESIS AND USE THEREOF AS PHARMACEUTICAL AGENT | VASOPHARM BIOTECH GMBH & CO KG (DE) | 2005-08-24 | — | — | EP | disclosed |
| US-6844343-B1 | Nitric oxide synthase inhibitors; strokes | VASOPHARM BIOTECH GMBH (DE) | 2005-01-18 | — | — | US | disclosed |
| EP-1216246-A1 | N-SUBSTITUTED 4-AMINOPTERIDINES, SYNTHESIS AND USE THEREOF AS PHARMACEUTICAL AGENT | Vasopharm Biotech GmbH & Co. KG (DE) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001021619-A1 | N-SUBSTITUTED 4-AMINOPTERIDINES, SYNTHESIS AND USE THEREOF AS PHARMACEUTICAL AGENT | VASOPHARM BIOTECH GMBH & CO. KG (DE) | 2001-03-29 | — | — | WO | disclosed |