Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PTGES | O14684 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10378184 | 0.85 | ALDH1A1 (0.69) | ALDH1A1HTTNPSR1RXFP1KMT2A | |
| SCHEMBL10379305 | 0.83 | ALDH1A1 (0.72) | ALDH1A1HTTNPSR1RXFP1ALOX5 | |
| SCHEMBL10378137 | 0.78 | ALDH1A1 (0.62) | ALDH1A1HTTNPSR1RXFP1ALOX5 | |
| SCHEMBL10379279 | 0.76 | ALDH1A1 (0.65) | ALDH1A1HTTNPSR1RXFP1KMT2A | |
| SCHEMBL10378154 | 0.75 | AR (0.55) | ALDH1A1HTTNPSR1RXFP1KMT2A | |
| SCHEMBL10379195 | 0.74 | MAPT (0.55) | ALDH1A1HTTNPSR1RXFP1KMT2A | |
| SCHEMBL10378189 | 0.73 | ALDH1A1 (0.57) | ALDH1A1NPSR1ALOX5KMT2AMAPT | |
| SCHEMBL10377940 | 0.72 | MAPT (0.53) | ALDH1A1HTTNPSR1RXFP1KMT2A | |
| SCHEMBL5743717 | 0.71 | CUL4A (0.40) | ALDH1A1HTTALOX5KMT2ALMNA | |
| SCHEMBL10379238 | 0.70 | ALDH1A1 (1.00) | ALDH1A1HTTNPSR1RXFP1KMT2A |
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-0377031-A1 | 5-DEAZA-5,7-DISUBSTITUTED-AMINOPTERIN ANALOGUES | Sloan-Kettering Institute For Cancer Research (US) | 1990-07-11 | — | — | EP | claimed |
| WO-1990000172-A1 | 5-DEAZA-5,7-DISUBSTITUTED-AMINOPTERIN ANALOGUES | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1990-01-11 | — | — | WO | claimed |