Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9817168 | 1.00 | ATM (0.57) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL9817165 | 1.00 | ATM (0.57) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL10414160 | 0.95 | HCAR2 (0.51) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL10414162 | 0.95 | HCAR2 (0.51) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL10414163 | 0.93 | HCAR2 (0.53) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL10413579 | 0.89 | HCAR2 (0.47) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL10413578 | 0.89 | HCAR2 (0.47) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL20912997 | 0.89 | HCAR2 (0.47) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL11563575 | 0.82 | ATM (0.63) | ATMTSHRHPGDNPSR1RAB9A | |
| SCHEMBL3355742 | 0.82 | ATM (0.52) | ATMTSHRHPGDNPSR1RAB9A |
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-0452094-A2 | A method of the preparation of N-hydroxy aspartic acid derivate | HOECHST CELANESE CORPORATION (US) | 1991-10-16 | — | — | EP | claimed |
| US-4973695-A | FROM UNSATURATED ALDEHYDE OR KETONE WITH OXODIESTER | SUGAI CHEMICAL IND. CO., LTD. (JP) | 1990-11-27 | — | — | US | disclosed |