Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.43 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL19622163 | 0.86 | HPGD (0.49) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL18510178 | 0.86 | HPGD (0.51) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL29380577 | 0.86 | HPGD (0.57) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL155342 | 0.86 | HPGD (0.57) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL10031015 | 0.86 | HPGD (0.51) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL14438986 | 0.86 | ALDH1A1 (0.51) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL16948529 | 0.85 | HPGD (0.56) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19444563 | 0.85 | HPGD (0.56) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL15281645 | 0.85 | HPGD (0.56) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21727772 | 0.84 | ALDH1A1 (0.53) | HPGDALDH1A1SMN1; SMN2NPC1RAB9A |
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-9649390-B2 | Pyrrolobenzodiazepines and conjugates thereof | MEDIMMUNE LIMITED (GB) | 2017-05-16 | — | — | US | disclosed |