Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6168415 | 0.91 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2NPC1PKMRAB9A | |
| SCHEMBL13800060 | 0.78 | TP53 (0.48) | KMT2AACHEBACE1 | |
| SCHEMBL4117314 | 0.74 | KCNH2 (0.39) | ALDH1A1NPC1KCNH2 | |
| Fumaric Acid SCHEMBL4118677 | 0.74 | ACHE (0.45) | NPC1RAB9AKMT2AACHEBACE1 | |
| Maleic Acid SCHEMBL4118674 | 0.74 | ACHE (0.45) | NPC1RAB9AKMT2AACHEBACE1 | |
| SCHEMBL6207985 | 0.73 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2KMT2AHPGDKCNH2 | |
| SCHEMBL4115040 | 0.73 | RECQL (0.47) | NPC1RAB9APOLBKDM1AHDAC1 | |
| SCHEMBL4032240 | 0.72 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2NPC1PKMRAB9A | |
| SCHEMBL4114136 | 0.72 | NPC1 (0.53) | ALDH1A1SMN1; SMN2NPC1RAB9AACHE | |
| SCHEMBL4114573 | 0.71 | DYRK1A (0.39) | SMN1; SMN2KMT2AKDM1AHDAC1 |
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-1494670-A1 | MEDICINE FOR TREATING CANCER | Kowa Co., Ltd. (JP) | 2005-01-12 | — | — | EP | disclosed |
| WO-2003086397-A1 | MEDICINE FOR TREATING CANCER | KOWA CO., LTD. (JP) | 2003-10-23 | — | — | WO | disclosed |