Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | TNF | P01375 | 2/20 | 0.43 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.43 |
| ▸ | MRGPRX1 | Q96LB2 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1567515 | 0.76 | MEN1 (0.36) | ALDH1A1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL28583043 | 0.73 | PDPK1 (0.63) | ALDH1A1RAB9ANPC1CYP1A2LMNA | |
| SCHEMBL3803974 | 0.71 | KDM4E (0.52) | ALDH1A1RAB9AKMT2ATNFNOD1 | |
| SCHEMBL347011 | 0.70 | MEN1 (0.47) | ALDH1A1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL3794735 | 0.70 | RAB9A (0.67) | ALDH1A1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL29087044 | 0.67 | PDPK1 (0.55) | ALDH1A1RAB9ANPC1CYP1A2LMNA | |
| SCHEMBL3801680 | 0.66 | MEN1 (0.71) | ALDH1A1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL12463180 | 0.66 | HPGDS (0.54) | ALDH1A1MEN1KMT2ACYP1A2CYP2C19 | |
| SCHEMBL443530 | 0.66 | CA12 (0.55) | ALDH1A1NPC1MEN1KMT2ACYP1A2 | |
| SCHEMBL29709902 | 0.66 | CA12 (0.55) | ALDH1A1NPC1MEN1KMT2ACYP1A2 |
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-2305221-A1 | Dna damage repair inhibitors for treatment of cancer | Kudos Pharmaceuticals Limited (GB) | 2011-04-06 | — | — | EP | disclosed |