Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 1/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7674335 | 0.90 | PRSS1 (0.49) | SRD5A2BCL2L1MCL1HDAC1HDAC8 | |
| SCHEMBL11220023 | 0.82 | SRD5A2 (0.54) | SRD5A2TRPV1HPGDALDH1A1 | |
| SCHEMBL28377134 | 0.79 | SRD5A2 (0.57) | SRD5A2HPGDKDM4ELMNAKMT2A | |
| SCHEMBL9150733 | 0.77 | SIGMAR1 (0.51) | SRD5A2HDAC1NPC1KDM4EKMT2A | |
| SCHEMBL11231215 | 0.76 | SRD5A2 (0.59) | SRD5A2SMN1; SMN2HPGDKDM4EKMT2A | |
| SCHEMBL28214103 | 0.76 | ALDH1A1 (0.48) | SRD5A2HDAC1HDAC8HDAC6NPC1 | |
| SCHEMBL10413178 | 0.74 | CYP4A11 (0.60) | NPC1RAB9ASMN1; SMN2TRPV1HPGD | |
| SCHEMBL27745360 | 0.72 | SRD5A2 (0.56) | SRD5A2HPGDKDM4ELMNAKMT2A | |
| SCHEMBL10411587 | 0.72 | TRPV1 (0.48) | HDAC1HDAC8HDAC6NPC1RAB9A | |
| SCHEMBL6563737 | 0.72 | EGLN1 (0.45) | SRD5A2RAB9AHPGDKDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |