Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ADH5 | P11766 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8134923 | 0.84 | HPGD (0.50) | HPGDALDH1A1LMNATSHRMEN1 | |
| SCHEMBL8144130 | 0.84 | ATM (0.52) | HPGDALDH1A1LMNATSHRMEN1 | |
| SCHEMBL8143968 | 0.81 | ALDH1A1 (0.47) | HPGDALDH1A1LMNATSHRMEN1 | |
| SCHEMBL70006 | 0.80 | ALDH1A1 (0.69) | HPGDALDH1A1LMNATSHRNPC1 | |
| SCHEMBL8135917 | 0.79 | ALDH1A1 (0.58) | HPGDALDH1A1LMNATSHRMEN1 | |
| SCHEMBL28669018 | 0.76 | SRD5A2 (0.57) | TSHRPDK2ADH5POLB | |
| SCHEMBL497989 | 0.76 | CA12 (0.53) | HPGDALDH1A1LMNAPDK2CYP1A2 | |
| SCHEMBL4195522 | 0.76 | ALDH1A1 (0.62) | HPGDALDH1A1LMNATSHRNPC1 | |
| SCHEMBL8143136 | 0.75 | GAA (0.51) | TSHRPDK2RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL4690924 | 0.75 | HPGD (0.61) | HPGDALDH1A1LMNATSHRNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6100272-A | Tetracyclic spiro compounds as 5HT1B receptor antagonists | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-08-08 | — | — | US | disclosed |