Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.42 |
| ▸ | F7 | P08709 | 1/20 | 0.42 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13267222 | 0.85 | GABRA1 (0.60) | ALDH1A1ATMHTR1DHTR1BGABRA1 | |
| SCHEMBL30934603 | 0.79 | F7 (0.55) | ALDH1A1GABRA1GABRB2LMNARAB9A | |
| SCHEMBL25253727 | 0.79 | F7 (0.55) | ALDH1A1GABRA1GABRB2LMNARAB9A | |
| SCHEMBL4232312 | 0.78 | KDM4E (0.57) | ALDH1A1GABRA1GABRB2LMNARAB9A | |
| SCHEMBL7222371 | 0.77 | HTR1D (0.51) | ALDH1A1ATMHTR1DHTR1BGABRA1 | |
| SCHEMBL8109983 | 0.76 | NR4A2 (0.67) | ALDH1A1ATMHTR1DLMNARAB9A | |
| SCHEMBL2546826 | 0.74 | ALDH1A1 (0.61) | ALDH1A1ATMHTR1DHTR1BLMNA | |
| SCHEMBL3389562 | 0.74 | ALDH1A1 (0.61) | ALDH1A1ATMHTR1DHTR1BLMNA | |
| SCHEMBL3169718 | 0.74 | ALDH1A1 (0.49) | ALDH1A1ATMGABRA1GABRB2NHERF1 | |
| SCHEMBL3590666 | 0.73 | F7 (0.75) | ALDH1A1ATMGABRA1GABRB2NHERF1 |
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-1418916-A1 | 2-AMINO-4-HETEROARYLAMINOPYRIMIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | Amgen Inc. (US) | 2004-05-19 | — | — | EP | disclosed |
| WO-2003018022-A1 | 2-AMINO-4-HETEROARYLAMINOPYRIMIDINE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER | AMGEN INC. (US) | 2003-03-06 | — | — | WO | disclosed |