Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30337109 | 0.86 | TSHR (0.47) | TSHRGPR84ACHEOPRM1OPRK1 | |
| SCHEMBL24939910 | 0.85 | HTR6 (0.41) | TSHRGPR84ACHEOPRM1OPRL1 | |
| SCHEMBL28980925 | 0.74 | KDM4E (0.50) | TSHRGPR84ACHEHTTHTR1A | |
| SCHEMBL24939864 | 0.74 | CHRNA7 (0.49) | OPRM1OPRK1HDAC8HDAC6FAAH | |
| SCHEMBL24939886 | 0.72 | HTR6 (0.45) | MEN1KMT2AHDAC1HDAC8HDAC6 | |
| SCHEMBL28980935 | 0.72 | KDM4E (0.47) | HTTHTR1AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL24939957 | 0.72 | F10 (0.41) | HTTKMT2AHDAC1HDAC8HDAC6 | |
| SCHEMBL30337432 | 0.72 | ALDH1A1 (0.46) | TSHROPRM1OPRK1OPRL1HTR1A | |
| SCHEMBL24939995 | 0.71 | HDAC3 (0.42) | HDAC1HDAC8HDAC6 | |
| SCHEMBL24938955 | 0.71 | LMNA (0.49) | TSHRGPR84MEN1KMT2AHDAC8 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021086038-A1 | NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME | 홀로스메딕 주식회사 | 2021-05-06 | — | — | WO | disclosed |