Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5296175 | 0.89 | MTNR1A (0.52) | ALDH1A1MTNR1AMTNR1BHPGDKDM4E | |
| SCHEMBL4417699 | 0.72 | KDM4E (0.58) | ALDH1A1HTTHSD17B10KDM4ELMNA | |
| SCHEMBL3863503 | 0.70 | ALOX5 (0.47) | ALDH1A1MTNR1AMTNR1BKDM4ELMNA | |
| SCHEMBL18824210 | 0.70 | MEN1 (0.51) | HSD17B10KDM4EPOLBSMN1; SMN2TP53 | |
| SCHEMBL13097792 | 0.69 | KMT2A (0.51) | TSHRALDH1A1HTTHSD17B10HPGD | |
| SCHEMBL8523338 | 0.68 | ALDH1A1 (0.54) | TSHRALDH1A1HTTHSD17B10HPGD | |
| SCHEMBL3986475 | 0.67 | KDM4E (0.66) | TSHRALDH1A1HSD17B10HPGDKDM4E | |
| SCHEMBL28115351 | 0.67 | JAK2 (0.60) | ALDH1A1HTTHSD17B10HPGDKDM4E | |
| SCHEMBL17157017 | 0.67 | ALDH1A1 (0.51) | TSHRALDH1A1FKBP1AHTTMAPT | |
| SCHEMBL6014774 | 0.66 | KDM4E (0.61) | ALDH1A1MTNR1AMTNR1BHSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007005779-A2 | ANTIVIRAL AGENTS | VIROBAY, INC. (US) | 2007-01-11 | — | — | WO | claimed |
| WO-2007005779-A2 | ANTIVIRAL AGENTS | VIROBAY, INC. (US) | 2007-01-11 | — | — | WO | disclosed |